data_6gsf_residue ############################ # Computer software used # ############################ 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 6gsf _Structure_validation_residue.Date_analyzed 2018-12-21 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 ' 78' ' ' SER . . . . . 0.498 ' H ' ' CG ' ' A' ' 92' ' ' ASP . 1.7 t . . . . . 0 CA--C 1.548 0.9 0 CA-C-O 121.958 0.885 . . . . 0.0 112.081 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -59.19 161.88 4.98 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.606 1.963 . . . . 0.0 112.369 172.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.9 p -114.27 165.66 12.45 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.3 1.048 . . . . 0.0 113.648 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.2 p -128.83 130.84 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 126.931 2.093 . . . . 0.0 109.961 -172.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -77.99 173.7 11.9 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.519 1.128 . . . . 0.0 111.477 174.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.01 3.96 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 127.617 2.367 . . . . 0.0 116.403 -173.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 15.2 m -152.55 30.41 0.53 Allowed 'General case' 0 N--CA 1.471 0.591 0 O-C-N 119.896 -1.753 . . . . 0.0 112.517 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 92.09 -128.17 9.26 Favored Glycine 0 CA--C 1.528 0.901 0 O-C-N 120.631 -1.293 . . . . 0.0 110.51 -167.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 57.08 172.74 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.821 1.248 . . . . 0.0 112.989 -169.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.3 122.16 43.19 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 120.977 -1.077 . . . . 0.0 109.321 172.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.7 mt -88.37 143.89 26.73 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 120.223 1.374 . . . . 0.0 111.622 173.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.5 mt -63.4 109.82 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.931 1.292 . . . . 0.0 110.037 -176.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 p -149.37 143.29 25.67 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.302 1.441 . . . . 0.0 110.847 -173.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 32.5 ttt-85 -71.65 -13.57 61.79 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -175.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.498 ' CG ' ' H ' ' A' ' 78' ' ' SER . 32.4 t70 -51.98 -40.47 60.99 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.699 1.2 . . . . 0.0 112.294 171.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 67.1 mt -54.55 -33.95 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.158 0.983 . . . . 0.0 111.572 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 40.1 ttt85 -83.38 -32.4 26.22 Favored 'General case' 0 N--CA 1.456 -0.144 0 O-C-N 120.941 -1.099 . . . . 0.0 111.686 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -61.98 -35.06 77.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.472 -0.142 . . . . 0.0 111.189 170.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.4 -52.84 56.17 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.144 1.378 . . . . 0.0 111.641 177.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -61.74 -46.0 91.53 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.652 -0.655 . . . . 0.0 112.322 172.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -59.77 -41.42 91.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.305 0.957 . . . . 0.0 112.346 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.92 -43.66 98.39 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.695 -0.628 . . . . 0.0 111.608 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -85.66 -12.88 50.19 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.4 mt -73.22 -40.05 65.01 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.635 1.107 . . . . 0.0 111.97 170.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.9 m . . . . . 0 N--CA 1.472 0.655 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 171.089 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.4 t0 . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 120.843 0.354 . . . . 0.0 111.269 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -70.09 -43.85 70.24 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.207 -0.933 . . . . 0.0 111.929 169.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 54.5 tp -51.13 -61.62 2.12 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.677 0.791 . . . . 0.0 111.44 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.8 ppt_? -60.13 -28.24 67.72 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.847 0.859 . . . . 0.0 112.763 -178.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.76 -41.82 74.67 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 173.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -59.79 -47.84 84.08 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.096 0.862 . . . . 0.0 112.163 176.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.1 mp -60.1 -42.66 90.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 118.517 0.599 . . . . 0.0 111.088 176.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.54 -23.49 65.44 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.42 -50.55 5.89 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.71 0.804 . . . . 0.0 112.735 174.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -76.94 -38.48 53.27 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.416 -1.427 . . . . 0.0 113.206 -170.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.66 -172.33 0.35 Allowed 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 120.199 1.363 . . . . 0.0 111.567 171.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -97.5 -120.34 0.13 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.632 1.173 . . . . 0.0 110.109 169.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.421 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 20.5 tt0 -120.26 -63.86 0.03 OUTLIER Pre-proline 0 CA--C 1.536 0.423 0 C-N-CA 125.699 1.6 . . . . 0.0 108.448 -172.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . 0.421 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.9 Cg_endo -67.22 -36.3 21.76 Favored 'Trans proline' 0 C--N 1.351 0.675 0 CA-C-N 120.641 1.265 . . . . 0.0 111.307 174.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.74 -34.25 72.71 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 120.833 -1.167 . . . . 0.0 112.477 176.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 19.0 ttt180 -63.09 -48.77 77.17 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.279 1.031 . . . . 0.0 110.434 172.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.14 -34.57 80.21 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 124.729 1.157 . . . . 0.0 113.514 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -75.25 -33.04 61.26 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 118.38 1.09 . . . . 0.0 111.171 174.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.03 -44.93 62.61 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.212 0.605 . . . . 0.0 111.132 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.35 -37.05 80.12 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.252 0.621 . . . . 0.0 112.365 174.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.22 -55.49 24.54 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 118.387 0.54 . . . . 0.0 111.696 175.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.8 mp -56.9 -30.47 63.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.2 175.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 9.3 tmm? -67.34 -52.05 44.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.215 0.916 . . . . 0.0 111.673 176.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -67.37 -38.33 84.6 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.45 -0.781 . . . . 0.0 112.583 177.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.11 -34.96 73.77 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.529 1.532 . . . . 0.0 112.224 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -63.13 -46.94 84.9 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.115 -0.99 . . . . 0.0 110.3 168.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 78.2 mt -60.58 -34.94 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.588 0.755 . . . . 0.0 112.269 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . 0.468 ' O ' ' OD1' ' A' ' 141' ' ' ASP . 48.4 t0 -67.37 -25.3 65.9 Favored 'General case' 0 C--N 1.34 0.177 0 C-N-CA 124.101 0.96 . . . . 0.0 111.63 -177.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -113.21 5.81 17.16 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? . . . . . 0 N--CA 1.479 1.022 0 O-C-N 120.675 -1.265 . . . . 0.0 112.94 -177.957 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.451 ' H ' ' CG ' ' A' ' 92' ' ' ASP . 2.9 t . . . . . 0 CA--C 1.545 0.781 0 CA-C-O 123.563 1.649 . . . . 0.0 112.045 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -68.8 165.75 19.04 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.44 -1.413 . . . . 0.0 111.043 165.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.5 p -134.43 160.33 38.33 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.729 0.776 . . . . 0.0 112.335 175.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.4 t -122.76 128.13 75.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 125.927 1.691 . . . . 0.0 108.193 -169.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -81.84 177.1 9.07 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.561 1.144 . . . . 0.0 112.726 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.93 -19.15 1.63 Allowed 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -170.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.5 m -134.69 29.93 3.48 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.039 1.336 . . . . 0.0 112.434 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 96.21 -123.12 7.59 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -171.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 50.1 m-20 59.22 178.62 0.08 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.66 1.184 . . . . 0.0 114.067 -176.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.12 127.37 54.11 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.369 -0.832 . . . . 0.0 109.114 168.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.8 mt -93.22 149.75 21.0 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 122.117 0.961 . . . . 0.0 110.957 168.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 16.7 mt -79.75 99.74 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 O-C-N 121.447 -0.783 . . . . 0.0 110.625 -173.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 30.1 p -118.28 -1.48 11.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.254 1.022 . . . . 0.0 113.398 170.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 64.95 -0.31 1.05 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.152 1.781 . . . . 0.0 115.389 -175.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.451 ' CG ' ' H ' ' A' ' 78' ' ' SER . 29.5 t70 -50.06 -49.5 51.05 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.843 1.657 . . . . 0.0 114.718 178.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.2 pt -52.6 -25.86 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 N-CA-C 113.72 1.008 . . . . 0.0 113.72 -176.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -61.66 -45.59 93.36 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.672 1.124 . . . . 0.0 112.145 171.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -58.29 -40.71 82.67 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.054 0.843 . . . . 0.0 111.637 173.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.47 -39.65 85.29 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.554 0.742 . . . . 0.0 111.983 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -70.88 -43.63 67.99 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.092 0.86 . . . . 0.0 112.603 171.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -59.14 -36.84 75.96 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.4 1.08 . . . . 0.0 112.234 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.89 -24.17 67.45 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 175.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -111.04 -11.78 14.26 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.429 1.092 . . . . 0.0 113.641 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.4 mt -75.93 -33.82 59.87 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.302 1.041 . . . . 0.0 111.008 167.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.4 p . . . . . 0 CA--C 1.538 0.486 0 C-N-CA 124.553 1.141 . . . . 0.0 112.13 170.836 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.477 0.887 0 CA-C-O 121.4 0.619 . . . . 0.0 110.939 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 85.2 mtm180 -65.37 -46.62 79.42 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.475 1.11 . . . . 0.0 111.007 176.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.1 tt -51.05 -64.01 0.95 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.626 1.17 . . . . 0.0 111.4 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -32.48 68.54 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.561 1.144 . . . . 0.0 112.809 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.87 87.38 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.904 -0.569 . . . . 0.0 112.127 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -60.79 -47.85 84.45 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.781 0.719 . . . . 0.0 112.116 176.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.3 mp -63.15 -45.03 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.155 0.889 . . . . 0.0 111.348 176.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.79 -29.74 69.01 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -179.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.67 -65.83 0.74 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.812 0.845 . . . . 0.0 110.899 172.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -70.72 -46.08 63.73 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.304 1.441 . . . . 0.0 113.403 -169.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 6.8 mp -78.58 164.13 24.93 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 120.727 -1.233 . . . . 0.0 109.809 168.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -79.09 -93.47 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.499 0.72 . . . . 0.0 112.329 -165.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -146.92 -54.6 0.02 OUTLIER Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 124.962 1.305 . . . . 0.0 111.198 175.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -70.84 -38.89 4.91 Favored 'Trans proline' 0 C--N 1.354 0.84 0 CA-C-N 121.449 1.553 . . . . 0.0 111.004 171.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.69 -42.08 64.46 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.221 1.408 . . . . 0.0 112.678 177.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -56.36 -49.29 74.82 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.766 2.026 . . . . 0.0 111.19 173.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.22 -34.38 67.13 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 125.151 1.357 . . . . 0.0 113.798 176.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -76.79 -31.19 56.83 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.457 1.128 . . . . 0.0 110.92 175.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.2 -50.98 50.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 122.87 0.468 . . . . 0.0 110.36 -178.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.7 pp -66.34 -35.77 81.21 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 177.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.65 -53.11 56.51 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.603 0.638 . . . . 0.0 112.019 174.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.67 -27.57 68.78 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 117.655 -1.164 . . . . 0.0 111.692 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -64.93 -53.09 51.86 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.866 1.212 . . . . 0.0 111.677 173.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -64.31 -41.45 96.84 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 177.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -68.41 -40.39 81.28 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.011 1.324 . . . . 0.0 112.671 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -58.19 -38.51 76.87 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.201 -0.937 . . . . 0.0 111.157 169.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 86.4 mt -71.23 -44.43 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 123.712 0.805 . . . . 0.0 112.387 177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -54.44 -31.43 55.39 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.608 1.563 . . . . 0.0 111.466 174.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -106.34 3.93 28.06 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 178.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt . . . . . 0 N--CA 1.485 1.279 0 C-N-CA 125.022 1.329 . . . . 0.0 112.875 179.018 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 C--O 1.238 0.487 0 CA-C-O 121.151 0.501 . . . . 0.0 109.701 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -53.48 154.96 3.18 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.435 1.112 . . . . 0.0 111.711 175.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 5.9 p -114.2 157.88 22.09 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.204 1.402 . . . . 0.0 111.722 -175.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.5 t -129.48 128.23 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 125.505 1.522 . . . . 0.0 107.478 -172.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -81.54 -175.17 5.38 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.736 0.814 . . . . 0.0 111.293 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.39 -21.0 8.44 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -172.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -144.73 50.79 1.26 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.291 1.036 . . . . 0.0 112.334 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.07 -122.82 5.84 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 120.376 -1.452 . . . . 0.0 110.826 -169.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 60.31 172.0 0.09 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.338 1.055 . . . . 0.0 112.964 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.59 119.14 38.65 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 170.29 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.62 143.52 38.17 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-O 121.568 0.699 . . . . 0.0 110.12 173.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 48.0 mm -73.23 108.33 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 O-C-N 121.56 -0.712 . . . . 0.0 109.932 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.2 p -152.32 158.24 42.47 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.991 1.316 . . . . 0.0 112.392 177.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -57.93 -14.23 5.9 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.488 1.515 . . . . 0.0 114.494 -174.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -66.15 -28.79 69.06 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 122.47 0.308 . . . . 0.0 111.7 -178.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.51 -53.99 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 121.285 0.564 . . . . 0.0 111.662 178.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -72.28 -28.75 63.31 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 118.587 -0.72 . . . . 0.0 112.818 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.48 -40.11 73.81 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.75 174.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.07 -51.25 58.78 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.819 1.247 . . . . 0.0 111.606 170.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -66.0 -36.12 82.42 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.034 -1.041 . . . . 0.0 112.056 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.57 -48.13 80.81 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.982 1.264 . . . . 0.0 111.306 173.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.44 -35.32 75.54 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.99 0.916 . . . . 0.0 112.644 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -91.04 -17.09 26.83 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.9 mt -72.98 -34.95 66.77 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 120.605 -1.31 . . . . 0.0 113.019 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 CA--C 1.545 0.781 0 CA-C-N 119.339 0.972 . . . . 0.0 113.096 175.045 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.2 t70 . . . . . 0 N--CA 1.472 0.649 0 N-CA-C 110.524 -0.176 . . . . 0.0 110.524 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -78.03 -41.29 36.17 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.767 0.827 . . . . 0.0 111.167 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 33.2 tp -55.99 -59.77 4.43 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.966 0.412 . . . . 0.0 111.994 177.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -24.83 64.44 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.349 -0.834 . . . . 0.0 113.002 -178.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.48 -51.27 53.34 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.864 0.756 . . . . 0.0 111.842 170.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -51.06 69.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.551 0.74 . . . . 0.0 110.812 173.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 62.1 mt -55.45 -43.7 73.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 O-C-N 121.7 -0.625 . . . . 0.0 111.461 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -77.8 -24.66 48.75 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -75.73 -42.54 50.41 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.606 0.763 . . . . 0.0 110.056 172.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -76.74 -61.13 2.07 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 124.598 1.159 . . . . 0.0 112.9 -178.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 57.5 mt -60.38 171.9 0.97 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.926 1.239 . . . . 0.0 112.221 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 10.8 tp-100 -71.48 -88.99 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.857 0.863 . . . . 0.0 111.936 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -166.13 -59.19 0.01 OUTLIER Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 125.645 1.578 . . . . 0.0 109.432 -172.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -63.2 -44.49 15.04 Favored 'Trans proline' 0 C--N 1.359 1.104 0 CA-C-N 120.357 1.163 . . . . 0.0 110.748 171.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.27 -37.54 75.17 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.435 1.094 . . . . 0.0 112.772 177.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 14.1 ttt180 -58.24 -47.24 84.15 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.484 0.714 . . . . 0.0 110.671 174.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -54.08 -45.47 72.45 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.299 0.952 . . . . 0.0 112.793 176.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.08 -37.19 83.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.01 0.905 . . . . 0.0 113.16 174.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.42 -50.01 61.26 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 120.627 1.558 . . . . 0.0 112.324 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.0 pp -65.45 -34.82 79.19 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.732 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.35 -48.38 75.75 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-O 119.054 -0.498 . . . . 0.0 111.301 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.0 mp -61.01 -28.07 68.77 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.349 -1.31 . . . . 0.0 111.471 175.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.39 -58.47 6.97 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 120.154 1.343 . . . . 0.0 111.851 172.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -66.75 -37.14 84.05 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.276 -0.89 . . . . 0.0 112.48 178.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.21 -45.02 90.1 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.154 1.382 . . . . 0.0 112.102 174.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -59.3 -42.26 90.93 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 118.876 -0.583 . . . . 0.0 110.609 171.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.99 -33.61 59.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-O 118.091 -0.957 . . . . 0.0 112.17 175.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -62.87 -44.04 97.18 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.398 0.999 . . . . 0.0 112.466 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -100.21 14.2 31.65 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 174.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 23.2 ttpt . . . . . 0 N--CA 1.483 1.189 0 O-C-N 120.639 -1.288 . . . . 0.0 112.865 -175.922 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 CA--C 1.546 0.82 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -62.07 154.31 27.29 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.824 1.25 . . . . 0.0 114.262 -168.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 35.8 p -92.24 152.92 19.59 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.067 1.347 . . . . 0.0 112.956 177.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.3 t -122.89 137.27 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 126.052 1.741 . . . . 0.0 107.926 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.4 ' HB3' HD21 ' A' ' 86' ' ' ASN . 15.5 t0 -75.8 175.64 8.53 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.428 1.091 . . . . 0.0 111.794 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.7 -12.38 1.83 Allowed 'General case' 0 CA--C 1.553 1.09 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 -174.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.8 m -155.63 64.53 0.6 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.773 1.629 . . . . 0.0 110.536 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 73.6 -123.96 8.48 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 121.709 -0.619 . . . . 0.0 111.97 -174.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.4 HD21 ' HB3' ' A' ' 82' ' ' ASP . 6.7 m-80 55.31 -179.51 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.864 1.265 . . . . 0.0 112.733 -172.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -115.3 127.23 55.31 Favored 'General case' 0 N--CA 1.481 1.116 0 O-C-N 120.291 -1.506 . . . . 0.0 110.747 171.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.8 mt -96.23 154.66 17.13 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 122.709 1.243 . . . . 0.0 112.863 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 32.6 mm -78.48 93.57 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 124.555 1.142 . . . . 0.0 111.235 -175.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . 0.255 13.7 t -132.15 12.96 4.69 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 66.82 -19.27 0.11 Allowed 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 116.671 2.1 . . . . 0.0 116.671 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -42.62 -51.22 5.27 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 126.385 1.874 . . . . 0.0 114.828 178.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 21.6 pt -55.51 -31.29 27.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.7 mtp85 -67.02 -43.77 81.98 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.164 -0.96 . . . . 0.0 111.527 175.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -69.51 -19.67 63.72 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.699 1.6 . . . . 0.0 112.919 176.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.86 -56.94 4.15 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.087 1.355 . . . . 0.0 111.246 167.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -59.82 -41.5 91.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.095 0.861 . . . . 0.0 112.89 -178.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -64.96 -37.68 88.46 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.875 0.761 . . . . 0.0 111.953 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.08 -30.44 70.35 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.415 0.895 . . . . 0.0 113.415 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -89.12 -38.23 14.48 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.793 0.837 . . . . 0.0 113.043 173.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.2 mt -59.02 -45.25 91.16 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.342 0.974 . . . . 0.0 111.041 176.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.3 m . . . . . 0 CA--C 1.546 0.812 0 C-N-CA 125.105 1.362 . . . . 0.0 114.307 177.697 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.468 0.45 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 70.1 mtt-85 -70.03 -44.94 68.22 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.665 -0.647 . . . . 0.0 111.81 171.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.2 tt -50.08 -61.55 2.09 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.231 1.013 . . . . 0.0 111.533 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.97 -27.51 68.33 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.514 -1.366 . . . . 0.0 113.387 179.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.69 -43.5 68.9 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 124.127 0.892 . . . . 0.0 111.566 177.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -53.98 -52.39 60.87 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.641 0.776 . . . . 0.0 111.545 176.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.18 -42.71 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 O-C-N 121.371 -0.831 . . . . 0.0 111.922 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.28 -31.03 68.21 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.029 -1.045 . . . . 0.0 113.596 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.08 -63.97 0.95 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.417 0.687 . . . . 0.0 110.483 169.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -62.06 -50.44 71.96 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.19 2.196 . . . . 0.0 113.929 -171.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -78.59 164.47 24.64 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 122.276 1.036 . . . . 0.0 110.328 176.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -77.2 -94.13 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.183 0.993 . . . . 0.0 111.447 -169.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.424 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 37.6 tt0 -140.79 -58.68 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 124.646 1.178 . . . . 0.0 110.454 167.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . 0.424 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.2 Cg_endo -66.88 -35.75 25.68 Favored 'Trans proline' 0 C--N 1.352 0.739 0 CA-C-N 122.036 1.763 . . . . 0.0 111.484 176.047 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.98 -32.01 67.46 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 120.98 -1.075 . . . . 0.0 112.779 173.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.14 -48.77 74.73 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.063 1.345 . . . . 0.0 109.903 173.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.19 -34.32 87.63 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 126.415 1.959 . . . . 0.0 114.49 176.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -74.98 -30.71 61.26 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.777 1.288 . . . . 0.0 110.475 173.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.86 58.42 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 122.909 0.484 . . . . 0.0 110.357 -176.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -66.51 -39.76 88.85 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 118.914 -0.565 . . . . 0.0 111.841 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.42 -54.54 44.3 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.37 0.986 . . . . 0.0 111.913 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 9.2 mp -64.45 -25.96 68.23 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.698 176.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 59.7 ttp -65.78 -53.02 45.96 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 120.056 1.298 . . . . 0.0 111.831 172.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . 0.407 ' HA ' HE21 ' A' ' 137' ' ' GLN . 0.0 OUTLIER -66.92 -43.15 84.03 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.122 0.874 . . . . 0.0 111.619 178.344 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -28.16 68.29 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.412 1.085 . . . . 0.0 112.846 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -68.0 -47.74 67.68 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.468 -1.395 . . . . 0.0 111.186 167.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 85.8 mt -62.27 -38.58 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.387 1.075 . . . . 0.0 112.561 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -52.98 -32.92 48.85 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.215 1.806 . . . . 0.0 113.09 173.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -112.85 2.69 16.02 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.405 1.482 . . . . 0.0 114.02 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? . . . . . 0 N--CA 1.48 1.045 0 C-N-CA 125.932 1.693 . . . . 0.0 112.681 175.814 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.467 0.404 0 CA-C-O 120.972 0.415 . . . . 0.0 110.0 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -78.1 178.98 7.12 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 128.041 2.536 . . . . 0.0 113.157 -174.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 32.5 p -115.35 161.67 18.19 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.771 1.229 . . . . 0.0 113.921 176.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.1 t -135.7 133.42 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 126.174 1.79 . . . . 0.0 109.541 -171.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -88.98 178.25 6.45 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.722 1.209 . . . . 0.0 112.961 177.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.53 -1.64 0.16 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 127.928 2.491 . . . . 0.0 117.718 -167.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 31.0 t -152.56 35.94 0.51 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.398 1.479 . . . . 0.0 111.372 173.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 87.47 -123.15 6.48 Favored Glycine 0 CA--C 1.529 0.912 0 O-C-N 120.934 -1.104 . . . . 0.0 110.649 -167.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 59.39 175.92 0.08 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.951 0.9 . . . . 0.0 111.665 -163.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.9 132.48 52.8 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 117.788 -1.101 . . . . 0.0 108.901 165.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.3 mt -98.69 150.51 21.72 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.916 1.235 . . . . 0.0 112.316 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 24.5 mt -63.62 111.81 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 125.144 1.378 . . . . 0.0 110.628 -173.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -142.74 154.38 44.22 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.76 1.224 . . . . 0.0 112.291 -173.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -101.03 -10.54 20.43 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -164.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -64.69 -29.48 70.47 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.892 0.877 . . . . 0.0 111.66 168.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 64.5 mt -49.77 -40.38 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 125.778 1.631 . . . . 0.0 112.103 175.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.18 -53.19 58.84 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 121.417 -0.802 . . . . 0.0 110.978 173.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -61.45 -30.0 70.31 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.823 0.849 . . . . 0.0 111.997 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.88 -53.52 52.84 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.984 1.714 . . . . 0.0 111.746 173.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -60.94 -43.55 98.51 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.32 -0.848 . . . . 0.0 112.416 173.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.47 -40.65 87.64 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.179 1.354 . . . . 0.0 112.636 177.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.88 -20.78 66.61 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -112.39 -21.74 11.22 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.365 1.066 . . . . 0.0 113.656 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.12 -48.94 74.12 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 118.998 0.817 . . . . 0.0 110.079 169.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 CA--C 1.54 0.563 0 C-N-CA 123.809 0.843 . . . . 0.0 113.137 179.231 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 55.4 t0 . . . . . 0 N--CA 1.474 0.775 0 CA-C-O 120.789 0.328 . . . . 0.0 110.809 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.4 mtt85 -59.97 -40.61 89.69 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.071 -1.018 . . . . 0.0 112.263 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 50.5 tp -62.12 -57.35 11.88 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.795 0.838 . . . . 0.0 112.496 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.6 ptm85 -60.91 -33.8 73.7 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.677 -0.639 . . . . 0.0 111.589 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.66 -44.02 87.58 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 124.198 0.936 . . . . 0.0 111.421 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.74 -42.7 81.42 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.477 0.711 . . . . 0.0 110.741 176.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 18.0 mt -61.09 -42.44 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.259 -0.901 . . . . 0.0 111.208 176.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.38 -22.2 61.91 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -84.64 -31.62 24.1 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 171.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -99.73 -34.77 10.04 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 115.324 1.601 . . . . 0.0 115.324 -173.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 60.2 mt -81.72 174.32 11.47 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.394 0.997 . . . . 0.0 111.611 167.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.34 -97.56 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.93 0.892 . . . . 0.0 111.525 -176.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 49.3 tt0 -145.43 -57.54 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.629 0 O-C-N 120.964 -1.085 . . . . 0.0 110.293 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.76 -37.94 8.49 Favored 'Trans proline' 0 C--N 1.355 0.897 0 CA-C-N 121.581 1.6 . . . . 0.0 112.133 173.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.73 -39.85 68.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.699 1.2 . . . . 0.0 112.157 176.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -58.17 -46.81 85.09 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.128 1.371 . . . . 0.0 110.74 174.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -56.3 -34.37 62.97 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 125.363 1.459 . . . . 0.0 113.621 175.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -77.61 -30.6 52.46 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 118.622 1.211 . . . . 0.0 111.494 175.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.36 -45.4 60.03 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.541 -0.725 . . . . 0.0 111.291 -178.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.79 -34.11 75.0 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.611 -0.709 . . . . 0.0 112.371 173.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.87 -53.58 56.18 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 119.144 0.884 . . . . 0.0 111.614 173.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 72.6 mt -55.41 -37.16 67.26 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.05 0.54 . . . . 0.0 111.328 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -52.51 46.56 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.051 0.94 . . . . 0.0 111.933 177.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -64.68 -38.94 92.71 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.735 -1.228 . . . . 0.0 112.834 178.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -43.76 98.19 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.837 1.255 . . . . 0.0 111.165 172.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -60.51 -39.87 89.32 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.533 -0.73 . . . . 0.0 111.566 172.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 59.7 mt -67.13 -35.21 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 119.934 1.243 . . . . 0.0 112.359 177.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -58.02 -49.78 75.68 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.492 0.717 . . . . 0.0 110.32 170.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -93.08 -0.53 57.05 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -173.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt . . . . . 0 N--CA 1.482 1.134 0 C-N-CA 124.437 1.095 . . . . 0.0 112.646 -178.73 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.7 t . . . . . 0 N--CA 1.475 0.782 0 CA-C-O 121.52 0.676 . . . . 0.0 109.951 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -63.24 163.92 9.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.504 1.122 . . . . 0.0 111.689 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.6 p -112.35 149.64 32.18 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.368 1.067 . . . . 0.0 113.072 -173.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.1 t -122.5 129.87 74.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.988 1.715 . . . . 0.0 109.67 -173.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.454 ' HB3' HD21 ' A' ' 86' ' ' ASN . 3.0 t0 -80.74 179.81 7.62 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.997 1.719 . . . . 0.0 112.537 178.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.29 -3.41 0.62 Allowed 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 116.603 2.075 . . . . 0.0 116.603 -172.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.7 m -162.6 64.59 0.21 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.671 1.988 . . . . 0.0 109.864 168.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.72 -123.91 6.4 Favored Glycine 0 CA--C 1.53 1.022 0 O-C-N 121.478 -0.764 . . . . 0.0 111.601 -177.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.454 HD21 ' HB3' ' A' ' 82' ' ' ASP . 7.1 m-80 57.25 179.42 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.848 1.259 . . . . 0.0 112.972 -171.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.79 118.6 36.59 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.242 -0.911 . . . . 0.0 109.376 169.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.8 mt -84.77 160.87 20.18 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 122.145 0.974 . . . . 0.0 111.611 171.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 15.9 mt -80.33 91.64 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 124.448 1.099 . . . . 0.0 110.4 -173.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 53.4 p -133.24 153.79 51.24 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.699 1.199 . . . . 0.0 110.708 164.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 8.9 tpp85 -70.49 -7.92 47.26 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -162.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -55.36 -44.93 76.45 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 127.108 2.163 . . . . 0.0 115.061 -167.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 39.5 pt -60.4 -28.47 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 123.826 0.851 . . . . 0.0 112.828 -173.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 62.5 ttt-85 -68.55 -35.89 78.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 122.672 0.389 . . . . 0.0 110.95 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -79.24 -34.24 42.88 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.283 0.633 . . . . 0.0 111.804 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.8 mp -56.96 -51.59 68.61 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.889 -0.577 . . . . 0.0 111.509 165.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -61.26 -42.96 99.53 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.956 0.798 . . . . 0.0 111.697 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.02 -41.88 97.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.33 0.968 . . . . 0.0 112.668 -179.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.92 -44.9 96.56 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.276 -0.89 . . . . 0.0 111.824 178.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -83.68 -8.96 59.17 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.2 mt -78.91 -33.19 45.76 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.812 1.187 . . . . 0.0 112.473 169.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 12.5 t . . . . . 0 N--CA 1.474 0.771 0 CA-C-N 119.259 0.936 . . . . 0.0 112.274 171.076 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 13.9 t0 . . . . . 0 N--CA 1.479 0.994 0 CA-C-O 120.98 0.419 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -69.3 -41.8 76.27 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 120.924 -1.11 . . . . 0.0 112.466 170.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 46.2 tp -51.47 -63.38 1.15 Allowed 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.044 0.537 . . . . 0.0 111.701 175.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -30.66 68.1 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.273 1.029 . . . . 0.0 112.75 177.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.54 -39.9 94.62 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 174.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -62.65 -51.38 67.5 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.062 0.846 . . . . 0.0 111.9 174.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.4 mp -58.75 -41.53 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.319 0.963 . . . . 0.0 111.118 177.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.1 -18.13 63.94 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -101.32 -33.2 10.13 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -78.52 -45.46 21.87 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.382 1.073 . . . . 0.0 112.45 177.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -84.89 174.88 9.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.12 0.968 . . . . 0.0 111.574 176.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.85 -99.99 0.1 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.282 0.633 . . . . 0.0 112.288 -177.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -135.22 -63.9 0.02 OUTLIER Pre-proline 0 N--CA 1.472 0.657 0 O-C-N 120.807 -1.183 . . . . 0.0 109.138 -179.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -68.58 -34.03 20.66 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 CA-C-N 121.127 1.438 . . . . 0.0 111.702 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.75 -36.39 78.8 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 120.77 -1.206 . . . . 0.0 112.078 174.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -63.91 -49.51 72.37 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.509 1.124 . . . . 0.0 110.413 172.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.32 -34.13 73.29 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.871 1.224 . . . . 0.0 113.879 178.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -75.08 -33.67 61.69 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.466 1.133 . . . . 0.0 110.682 175.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.47 -46.13 64.36 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.698 -0.626 . . . . 0.0 110.926 -176.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.29 -36.63 79.65 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 118.804 -0.617 . . . . 0.0 112.176 174.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.7 -54.08 49.63 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.301 0.955 . . . . 0.0 111.976 175.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 97.0 mt -58.7 -34.73 71.64 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.395 176.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 49.5 ttp -65.38 -52.02 56.45 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.4 0.68 . . . . 0.0 112.26 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -64.33 -42.9 96.06 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.768 -0.582 . . . . 0.0 111.604 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -44.9 95.99 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.604 1.162 . . . . 0.0 111.715 176.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -59.9 -44.48 94.22 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.155 0.434 . . . . 0.0 111.467 174.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 74.6 mt -62.24 -35.32 68.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 118.686 0.675 . . . . 0.0 111.414 176.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -63.02 -32.19 73.5 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.029 0.932 . . . . 0.0 113.111 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 3.5 p90 -108.81 -0.14 20.05 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 116.242 1.941 . . . . 0.0 116.242 174.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt . . . . . 0 N--CA 1.48 1.072 0 C-N-CA 125.752 1.621 . . . . 0.0 112.634 178.018 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.8 t . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 120.918 0.39 . . . . 0.0 111.397 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -65.78 152.79 43.54 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.801 0.81 . . . . 0.0 111.602 177.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 98.5 p -133.56 157.8 44.77 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.867 0.841 . . . . 0.0 113.002 -173.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.6 t -127.71 130.93 70.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.338 1.455 . . . . 0.0 110.088 -166.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -79.12 173.32 12.7 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.346 1.858 . . . . 0.0 113.632 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.54 -10.12 2.03 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 -177.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 19.8 m -138.29 29.88 2.44 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.793 1.637 . . . . 0.0 111.848 175.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 93.13 -109.08 3.74 Favored Glycine 0 C--N 1.339 0.746 0 O-C-N 120.445 -1.409 . . . . 0.0 110.766 -173.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 52.05 -172.16 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.679 1.191 . . . . 0.0 113.758 -174.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -113.48 126.03 54.87 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 164.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.5 mt -91.61 140.96 29.23 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.338 0.972 . . . . 0.0 110.27 170.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 31.6 mm -80.68 105.46 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.917 0.865 . . . . 0.0 110.851 -178.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.1 p -132.56 22.63 4.33 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 125.255 1.422 . . . . 0.0 113.247 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 64.24 -4.39 0.41 Allowed 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 126.811 2.045 . . . . 0.0 115.88 177.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -54.78 -53.83 50.08 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 129.23 3.012 . . . . 0.0 114.834 178.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 30.2 pt -54.77 -33.3 27.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.928 0.891 . . . . 0.0 113.177 -177.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -65.01 -38.58 91.41 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.984 1.265 . . . . 0.0 112.217 177.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -67.97 -35.11 77.81 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.238 0.615 . . . . 0.0 111.553 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.18 -44.02 80.72 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.807 0.843 . . . . 0.0 111.35 174.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -63.6 -43.6 96.44 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.099 0.863 . . . . 0.0 112.693 171.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -58.09 -46.43 85.51 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.599 1.09 . . . . 0.0 112.75 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.62 -30.97 67.66 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -102.19 -12.17 18.23 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 24.7 mt -74.86 -41.1 60.46 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.617 1.098 . . . . 0.0 111.376 167.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 5.7 t . . . . . 0 CA--C 1.541 0.619 0 CA-C-N 118.322 0.51 . . . . 0.0 110.852 175.875 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 58.6 t0 . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 111.417 0.154 . . . . 0.0 111.417 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -66.23 -35.47 80.51 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 118.451 -0.785 . . . . 0.0 111.821 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 55.3 tp -57.94 -61.81 2.27 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.623 0.769 . . . . 0.0 111.025 176.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -60.58 -27.79 67.97 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.278 -0.889 . . . . 0.0 112.726 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.07 -37.53 66.76 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.86 0.864 . . . . 0.0 113.044 173.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -63.68 -53.38 52.22 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.096 -0.954 . . . . 0.0 111.499 174.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.7 mp -55.79 -36.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 120.633 1.56 . . . . 0.0 111.537 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.522 ' HA ' ' HD2' ' A' ' 129' ' ' ARG . . . -70.68 -24.78 62.74 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.537 1.68 . . . . 0.0 115.537 178.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -99.22 -29.31 12.9 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.997 1.319 . . . . 0.0 113.785 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -82.26 -46.14 14.08 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.484 1.514 . . . . 0.0 113.694 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 7.5 mp -89.21 176.3 7.01 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.02 0.928 . . . . 0.0 110.495 171.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.38 -96.94 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.941 0.896 . . . . 0.0 111.767 -175.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.416 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 34.7 tt0 -155.03 -52.65 0.02 OUTLIER Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 124.96 1.304 . . . . 0.0 110.909 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . 0.416 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 56.7 Cg_endo -64.78 -43.9 11.59 Favored 'Trans proline' 0 C--N 1.353 0.804 0 CA-C-N 121.673 1.633 . . . . 0.0 109.948 167.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -49.97 -38.83 38.68 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.851 1.261 . . . . 0.0 113.007 172.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.522 ' HD2' ' HA ' ' A' ' 121' ' ' ALA . 26.5 ttt180 -72.19 -42.53 65.73 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 121.602 -0.686 . . . . 0.0 110.869 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.8 -32.62 75.08 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-O 119.524 -0.598 . . . . 0.0 113.976 175.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -79.28 -30.35 42.93 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.34 1.07 . . . . 0.0 111.29 175.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.36 -46.91 63.16 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.646 -0.659 . . . . 0.0 111.109 -178.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.7 pp -66.79 -36.63 82.85 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.308 0.643 . . . . 0.0 112.393 175.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.99 -52.0 64.67 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.659 -0.65 . . . . 0.0 112.426 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.86 -28.82 69.76 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.489 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 9.4 tmm? -67.36 -53.47 29.19 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.044 0.838 . . . . 0.0 112.105 175.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.59 -42.32 98.69 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.07 -1.019 . . . . 0.0 113.363 172.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.37 -42.29 96.25 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.167 0.987 . . . . 0.0 111.959 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 32.7 t80 -59.56 -43.83 93.46 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.751 -0.593 . . . . 0.0 111.242 171.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.11 -41.74 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-O 118.667 -0.683 . . . . 0.0 112.132 -178.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -61.16 -49.91 75.31 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.091 0.956 . . . . 0.0 111.523 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.9 m-30 -89.01 6.62 38.84 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -175.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt . . . . . 0 N--CA 1.479 1.005 0 C-N-CA 125.194 1.397 . . . . 0.0 112.188 174.013 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.4 t . . . . . 0 N--CA 1.475 0.804 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.834 ' HA ' ' OD1' ' A' ' 92' ' ' ASP . 6.6 p90 -147.54 172.96 13.17 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -164.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 94.0 p -88.29 168.03 13.05 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.821 2.049 . . . . 0.0 114.883 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 p -154.22 136.89 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 125.541 1.537 . . . . 0.0 111.484 -177.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -84.35 170.95 13.1 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.632 1.173 . . . . 0.0 111.579 173.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.96 3.76 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 117.688 2.477 . . . . 0.0 117.688 -170.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 39.5 m -159.22 52.09 0.38 Allowed 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.008 1.723 . . . . 0.0 110.109 168.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.89 -124.35 6.43 Favored Glycine 0 CA--C 1.528 0.899 0 O-C-N 120.2 -1.562 . . . . 0.0 111.228 -174.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 59.79 177.8 0.09 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.333 1.053 . . . . 0.0 111.615 -169.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.1 mt -112.14 128.23 56.16 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.824 -1.172 . . . . 0.0 109.536 170.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mt -95.52 161.83 13.9 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.992 0.901 . . . . 0.0 111.807 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.4 mm -83.87 89.64 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 124.599 1.16 . . . . 0.0 111.494 -173.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 69.3 p -141.62 166.43 24.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.709 175.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.401 ' CG ' ' HD3' ' A' ' 94' ' ' ARG . 43.7 ttm-85 -93.02 45.41 1.18 Allowed 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 115.005 -0.998 . . . . 0.0 113.398 -164.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.834 ' OD1' ' HA ' ' A' ' 79' ' ' PHE . 0.2 OUTLIER -102.71 -60.16 1.59 Allowed 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.614 -0.679 . . . . 0.0 112.691 -178.358 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 20.8 pt -47.41 -24.04 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -176.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.401 ' HD3' ' CG ' ' A' ' 91' ' ' ARG . 9.5 ptm85 -74.06 -31.03 62.69 Favored 'General case' 0 N--CA 1.456 -0.127 0 O-C-N 120.896 -1.127 . . . . 0.0 111.249 -177.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -74.4 -32.03 62.55 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.317 1.047 . . . . 0.0 111.032 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.3 tt -63.44 -52.75 60.14 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.577 1.551 . . . . 0.0 110.661 176.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -56.58 -46.01 81.02 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.295 -0.878 . . . . 0.0 112.731 169.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.57 -38.87 85.98 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 119.661 1.119 . . . . 0.0 112.55 -179.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.82 -37.17 83.45 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.189 0.996 . . . . 0.0 112.982 178.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -99.85 -3.66 32.07 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 34.7 mt -82.85 -24.06 33.42 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.194 -0.942 . . . . 0.0 112.892 166.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 70.2 m . . . . . 0 N--CA 1.452 -0.338 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 170.257 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 t0 . . . . . 0 CA--C 1.536 0.409 0 N-CA-C 111.48 0.178 . . . . 0.0 111.48 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -72.14 -45.01 62.23 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 117.568 -1.206 . . . . 0.0 111.767 172.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 42.6 tp -49.47 -63.36 1.13 Allowed 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 118.995 0.816 . . . . 0.0 111.791 176.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -60.8 -30.91 70.34 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.911 -1.118 . . . . 0.0 112.709 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.38 -38.03 84.1 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 175.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -60.33 -51.2 70.51 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 119.15 0.886 . . . . 0.0 111.131 173.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.5 mp -58.59 -42.26 84.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-N 119.107 0.867 . . . . 0.0 111.318 175.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.02 -20.97 63.24 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 115.344 1.609 . . . . 0.0 115.344 -178.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -98.05 -37.39 9.77 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.881 1.272 . . . . 0.0 113.218 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -73.12 -52.43 14.26 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.724 0.81 . . . . 0.0 112.979 173.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -83.83 159.18 21.44 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 122.4 1.095 . . . . 0.0 109.983 175.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -77.67 -84.41 0.07 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.423 -169.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -153.72 -61.6 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 117.961 -1.018 . . . . 0.0 110.405 -178.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -66.65 -38.33 18.83 Favored 'Trans proline' 0 C--N 1.352 0.761 0 CA-C-N 121.437 1.549 . . . . 0.0 110.731 170.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.14 -35.11 71.03 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 121.024 -1.047 . . . . 0.0 112.743 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 35.3 ttt180 -63.4 -47.62 81.23 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.879 1.272 . . . . 0.0 110.379 172.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.06 -34.72 73.77 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.258 1.408 . . . . 0.0 114.148 177.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -75.64 -32.8 60.37 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.356 1.078 . . . . 0.0 110.725 175.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.96 -46.69 64.73 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.734 -0.604 . . . . 0.0 110.968 -177.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.53 -35.35 77.34 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.37 -53.45 56.45 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.488 0.586 . . . . 0.0 112.064 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 88.4 mt -58.47 -34.1 70.5 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.246 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 44.1 ttp -65.53 -50.5 64.99 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.294 0.638 . . . . 0.0 112.469 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -64.65 -44.35 90.72 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.145 0.884 . . . . 0.0 112.172 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.2 -38.79 90.47 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.145 0.978 . . . . 0.0 111.426 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -62.92 -45.99 89.88 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.152 -0.968 . . . . 0.0 111.777 171.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 70.3 mt -64.96 -34.84 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 121.277 -0.89 . . . . 0.0 112.561 -177.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -61.51 -65.14 0.74 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.715 1.206 . . . . 0.0 110.356 169.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 12.4 m-30 -76.26 -2.94 33.87 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.893 1.277 . . . . 0.0 114.234 -171.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt . . . . . 0 N--CA 1.476 0.847 0 C-N-CA 125.636 1.575 . . . . 0.0 112.035 170.107 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.473 0.711 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -66.31 170.28 6.15 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.161 -0.962 . . . . 0.0 112.573 173.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.1 p -110.38 161.1 15.98 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.959 1.304 . . . . 0.0 113.418 176.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.9 t -123.27 135.56 62.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 125.701 1.6 . . . . 0.0 109.748 -175.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -80.42 173.66 12.38 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.571 1.549 . . . . 0.0 112.767 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.5 -28.73 32.61 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -170.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.8 m -128.88 43.42 3.15 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.588 1.955 . . . . 0.0 111.029 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.25 -122.12 5.84 Favored Glycine 0 CA--C 1.528 0.9 0 O-C-N 120.938 -1.101 . . . . 0.0 111.288 -174.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 56.12 -176.58 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.319 1.048 . . . . 0.0 113.562 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mt -110.1 133.63 53.01 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.214 -0.928 . . . . 0.0 109.575 173.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 12.8 mt -106.31 144.36 33.12 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 122.005 0.907 . . . . 0.0 110.693 169.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 23.4 mt -64.95 113.63 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 124.151 0.98 . . . . 0.0 110.238 -173.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -143.19 142.09 31.33 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.205 1.402 . . . . 0.0 111.344 -175.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 27.0 ttm180 -65.88 -25.49 67.2 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.507 1.123 . . . . 0.0 112.972 -173.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.43 -29.89 68.08 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 128.649 2.78 . . . . 0.0 112.334 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 82.1 mt -56.27 -39.06 57.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.336 1.054 . . . . 0.0 111.647 173.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -68.22 -35.88 78.66 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 121.006 -1.059 . . . . 0.0 112.362 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -66.23 -31.31 72.05 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.058 0.543 . . . . 0.0 111.251 173.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.36 -44.63 78.53 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.944 0.897 . . . . 0.0 111.457 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -63.87 -44.96 91.5 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 118.285 -0.864 . . . . 0.0 113.176 167.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -39.79 94.48 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 120.624 1.556 . . . . 0.0 112.453 -177.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.94 -13.05 42.8 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -113.95 -12.17 12.68 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.546 1.138 . . . . 0.0 113.241 172.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 34.0 mt -78.9 -39.53 34.72 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.385 0.993 . . . . 0.0 111.484 172.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.1 p . . . . . 0 N--CA 1.471 0.582 0 CA-C-N 118.986 0.812 . . . . 0.0 110.95 171.362 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.3 t0 . . . . . 0 N--CA 1.468 0.466 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 19.5 ptt-85 -64.74 -31.08 72.15 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 117.846 -1.073 . . . . 0.0 113.356 171.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.21 -61.27 2.48 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.563 1.074 . . . . 0.0 109.995 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -59.35 -29.69 67.85 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.508 1.123 . . . . 0.0 113.189 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.03 -45.21 71.03 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.602 0.761 . . . . 0.0 112.183 173.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -53.42 -48.97 68.26 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.066 0.946 . . . . 0.0 112.597 176.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.422 HG21 ' HG3' ' A' ' 129' ' ' ARG . 3.9 mp -62.12 -38.62 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 O-C-N 121.372 -0.83 . . . . 0.0 111.864 175.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.66 -24.63 61.06 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -83.64 -42.37 16.76 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.684 1.194 . . . . 0.0 112.486 173.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -79.12 -46.94 17.01 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.702 1.201 . . . . 0.0 113.04 -178.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -88.27 171.77 9.93 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 122.654 1.216 . . . . 0.0 110.935 177.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.92 -108.16 0.09 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.736 1.215 . . . . 0.0 111.749 -176.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 47.7 tt0 -126.68 -63.9 0.02 OUTLIER Pre-proline 0 N--CA 1.47 0.552 0 O-C-N 120.337 -1.477 . . . . 0.0 108.975 -175.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.78 -38.37 10.35 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 120.764 1.309 . . . . 0.0 111.568 173.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.9 -29.65 68.49 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.028 -1.045 . . . . 0.0 111.957 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.422 ' HG3' HG21 ' A' ' 120' ' ' ILE . 51.6 ttt180 -72.73 -45.45 58.63 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.942 0.401 . . . . 0.0 110.183 177.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.57 -35.49 80.73 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 115.459 -0.792 . . . . 0.0 113.762 176.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -72.65 -34.59 67.38 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.467 1.134 . . . . 0.0 110.747 175.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.03 -44.02 61.31 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.167 0.587 . . . . 0.0 111.285 -174.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -69.6 -36.18 75.98 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 119.032 -0.508 . . . . 0.0 112.074 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.66 -53.56 54.55 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.067 0.849 . . . . 0.0 111.782 174.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.4 mt -56.29 -35.29 67.34 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.679 0.792 . . . . 0.0 111.501 175.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 53.4 ttp -66.86 -51.3 57.12 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.434 0.693 . . . . 0.0 112.561 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -64.44 -40.8 96.44 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.436 -0.79 . . . . 0.0 111.66 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.06 -43.68 98.3 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.84 1.256 . . . . 0.0 111.377 176.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -60.35 -45.21 94.28 Favored 'General case' 0 C--O 1.221 -0.426 0 O-C-N 121.636 -0.665 . . . . 0.0 111.241 173.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 85.5 mt -67.94 -34.34 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.743 0.817 . . . . 0.0 112.861 -178.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -69.58 -49.69 51.75 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.617 0.767 . . . . 0.0 111.406 172.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 14.0 m-30 -79.93 -0.42 34.96 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.125 -0.984 . . . . 0.0 113.49 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt . . . . . 0 N--CA 1.483 1.197 0 C-N-CA 126.441 1.896 . . . . 0.0 113.316 177.852 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.4 t . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -50.08 156.66 0.75 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 128.509 2.724 . . . . 0.0 114.432 175.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.7 p -106.27 157.81 17.32 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.547 1.139 . . . . 0.0 112.995 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.5 t -124.45 129.92 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.374 1.47 . . . . 0.0 110.0 -171.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -77.32 171.01 15.53 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.985 2.114 . . . . 0.0 113.138 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.14 2.71 0.08 Allowed 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 127.72 2.408 . . . . 0.0 116.373 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 42.7 m -154.05 37.26 0.44 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.529 1.931 . . . . 0.0 111.31 169.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.84 -103.84 3.1 Favored Glycine 0 CA--C 1.527 0.789 0 O-C-N 120.872 -1.143 . . . . 0.0 111.854 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 49.89 -166.89 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.304 1.442 . . . . 0.0 112.88 -172.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mt -122.56 129.99 52.53 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 120.598 -1.314 . . . . 0.0 108.214 162.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.8 mt -99.66 143.3 30.05 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.996 0.903 . . . . 0.0 111.388 174.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 48.3 mm -61.31 125.04 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 123.901 0.88 . . . . 0.0 110.91 -174.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.5 p -155.39 150.6 26.9 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.487 1.915 . . . . 0.0 110.335 -168.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 30.3 ttm180 -88.45 -12.16 43.91 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 -168.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -67.87 -29.38 68.48 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 117.613 -1.184 . . . . 0.0 111.803 169.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 45.4 mm -51.62 -36.56 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 119.972 1.26 . . . . 0.0 112.064 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.4 ttt85 -74.58 -41.16 60.99 Favored 'General case' 0 CA--C 1.521 -0.15 0 O-C-N 121.007 -1.058 . . . . 0.0 110.775 178.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -64.78 -28.28 69.47 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.437 176.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 tt -64.77 -47.75 77.01 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.478 1.511 . . . . 0.0 110.866 174.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -66.68 -42.3 86.75 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.61 -0.682 . . . . 0.0 112.451 171.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -58.12 -43.91 87.44 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.574 1.079 . . . . 0.0 112.842 177.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.69 -34.33 75.57 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -175.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -88.04 -32.19 18.91 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.525 1.13 . . . . 0.0 113.001 178.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.8 mt -57.21 -51.06 70.87 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.824 1.193 . . . . 0.0 110.696 170.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 62.6 m . . . . . 0 CA--C 1.539 0.527 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 177.694 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.71 -39.34 84.37 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.42 -0.8 . . . . 0.0 112.94 172.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 35.2 tp -59.65 -57.71 11.77 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.542 1.065 . . . . 0.0 111.917 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -23.24 66.76 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.61 -31.14 32.63 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.316 1.046 . . . . 0.0 113.04 176.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.66 -44.45 56.77 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.546 0.739 . . . . 0.0 110.484 173.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 15.3 mt -57.59 -41.26 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 CA-C-O 121.525 0.679 . . . . 0.0 111.533 173.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.46 -21.31 66.63 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -95.02 -23.12 17.5 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 176.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -90.64 -40.35 11.95 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 35.3 mt -83.81 179.7 7.51 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.776 2.031 . . . . 0.0 113.301 177.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -91.43 -96.05 0.12 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.63 1.172 . . . . 0.0 112.167 -173.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -140.85 -62.22 0.02 OUTLIER Pre-proline 0 N--CA 1.47 0.558 0 O-C-N 120.716 -1.24 . . . . 0.0 109.956 170.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.57 -35.76 36.73 Favored 'Trans proline' 0 C--N 1.352 0.761 0 CA-C-N 121.276 1.491 . . . . 0.0 111.106 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -47.84 -47.74 31.25 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.999 1.319 . . . . 0.0 112.628 168.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -62.76 -48.03 80.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.965 1.306 . . . . 0.0 110.458 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.13 -34.77 74.43 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.568 1.08 . . . . 0.0 113.649 178.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -75.77 -33.48 60.2 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.483 1.142 . . . . 0.0 110.986 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.2 61.2 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.691 -0.63 . . . . 0.0 111.055 -174.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -67.05 -36.84 82.94 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.967 173.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.11 -55.18 35.45 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 119.378 0.99 . . . . 0.0 111.312 175.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 92.4 mt -53.79 -36.63 62.64 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.283 1.033 . . . . 0.0 111.847 174.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 40.9 ttp -67.2 -50.6 60.3 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.648 0.658 . . . . 0.0 112.353 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -43.58 93.39 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.454 -0.778 . . . . 0.0 111.271 177.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -39.09 93.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.604 1.562 . . . . 0.0 112.377 178.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -64.06 -39.99 95.28 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.167 -0.958 . . . . 0.0 111.985 173.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 83.9 mt -72.18 -35.07 51.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.233 1.013 . . . . 0.0 112.059 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 62.0 t0 -62.42 -62.59 1.65 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.07 2.148 . . . . 0.0 110.81 172.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -78.87 -1.21 33.96 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -177.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 23.0 ttmt . . . . . 0 N--CA 1.482 1.13 0 C-N-CA 124.715 1.206 . . . . 0.0 112.878 -173.564 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.48 1.029 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -77.53 -176.02 4.07 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.917 1.287 . . . . 0.0 112.083 176.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.5 p -147.36 166.42 27.19 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 120.574 -1.328 . . . . 0.0 112.772 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 p -135.66 130.28 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.063 1.745 . . . . 0.0 111.379 -165.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -75.38 168.97 18.98 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.701 2.0 . . . . 0.0 112.548 172.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -50.29 -17.25 0.42 Allowed 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 -176.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.9 m -139.09 41.9 2.09 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 127.411 2.285 . . . . 0.0 111.674 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 92.38 -123.93 7.48 Favored Glycine 0 C--N 1.35 1.338 0 O-C-N 119.524 -1.985 . . . . 0.0 110.372 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 62.7 m-20 55.92 -178.94 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.584 1.153 . . . . 0.0 112.677 -171.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.48 114.84 28.22 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 172.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 12.1 mt -83.49 148.39 27.26 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 122.161 0.981 . . . . 0.0 111.951 175.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 22.9 mt -66.51 101.19 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.612 1.165 . . . . 0.0 110.089 -173.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -145.96 138.96 25.84 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.652 1.581 . . . . 0.0 110.086 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 34.5 ttp180 -78.29 42.35 0.41 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.119 1.368 . . . . 0.0 113.739 -170.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.33 -59.59 2.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.292 1.037 . . . . 0.0 113.317 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.0 pt -54.31 -31.3 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.426 1.49 . . . . 0.0 114.297 -167.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -60.09 -40.43 89.58 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.644 -0.66 . . . . 0.0 112.299 176.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -73.82 -32.39 63.68 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.52 0.728 . . . . 0.0 109.741 -173.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.1 mp -60.77 -51.01 71.16 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.619 0.767 . . . . 0.0 110.885 167.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.6 m-30 -60.17 -45.27 93.67 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 118.382 -0.818 . . . . 0.0 112.292 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -62.68 -38.05 88.83 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.536 1.134 . . . . 0.0 112.659 178.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.11 -41.29 97.3 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.206 0.912 . . . . 0.0 111.902 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -84.61 -28.24 26.65 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.571 -0.705 . . . . 0.0 112.665 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 43.8 mt -59.01 -33.29 70.55 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.643 1.11 . . . . 0.0 111.195 166.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.2 m . . . . . 0 CA--C 1.544 0.732 0 C-N-CA 125.595 1.558 . . . . 0.0 113.952 175.677 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.471 0.578 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 33.2 ptt180 -70.09 -32.68 70.86 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 118.625 -0.702 . . . . 0.0 112.881 171.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.4 tt -57.52 -60.38 3.75 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.966 0.803 . . . . 0.0 109.991 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.56 -31.92 66.6 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.804 0.841 . . . . 0.0 112.162 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.4 -37.52 80.41 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.118 0.567 . . . . 0.0 112.173 -177.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -61.18 -50.13 74.37 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.492 171.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.15 -39.49 80.68 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.413 0 CA-C-N 119.161 0.891 . . . . 0.0 111.578 177.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.85 -21.46 63.35 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -99.59 -21.38 15.9 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.73 1.212 . . . . 0.0 114.167 176.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -104.68 -38.12 6.83 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 120.357 -0.537 . . . . 0.0 112.237 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -87.67 156.63 19.38 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 122.491 1.139 . . . . 0.0 110.096 169.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.61 -88.47 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.944 0.898 . . . . 0.0 112.371 -166.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -150.07 -58.48 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.735 0 O-C-N 121.096 -1.003 . . . . 0.0 111.01 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -69.66 -36.24 11.43 Favored 'Trans proline' 0 C--N 1.353 0.776 0 CA-C-N 121.637 1.621 . . . . 0.0 111.113 167.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.97 -39.46 81.81 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 120.945 -1.097 . . . . 0.0 111.847 173.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 43.2 ttt180 -60.4 -51.24 70.33 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.211 1.405 . . . . 0.0 110.167 172.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -60.0 -31.02 71.32 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.018 1.294 . . . . 0.0 114.57 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.68 -30.23 41.05 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.768 1.284 . . . . 0.0 111.039 173.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.92 -44.3 55.51 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.414 -0.804 . . . . 0.0 111.138 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -66.99 -34.78 78.5 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 174.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.54 -56.36 22.27 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.003 0.521 . . . . 0.0 111.206 172.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.9 mp -58.45 -33.18 69.44 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.568 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 49.8 ttp -63.3 -48.21 79.03 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.708 0.803 . . . . 0.0 112.887 175.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -75.36 -29.54 59.94 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 120.761 -1.212 . . . . 0.0 112.775 176.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -41.99 76.63 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 124.873 1.269 . . . . 0.0 110.703 -178.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -35.24 79.63 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.687 -0.633 . . . . 0.0 111.072 176.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 87.8 mt -65.77 -40.31 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.797 0.839 . . . . 0.0 110.952 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -60.01 -19.28 51.73 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.442 1.097 . . . . 0.0 113.918 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -118.77 3.84 11.6 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.414 1.485 . . . . 0.0 114.385 176.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 11.9 tppt? . . . . . 0 N--CA 1.48 1.058 0 C-N-CA 124.663 1.185 . . . . 0.0 112.234 -177.623 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.3 t . . . . . 0 CA--C 1.551 0.981 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -51.48 170.27 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 129.388 3.075 . . . . 0.0 115.517 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.6 p -107.52 162.89 13.53 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.449 1.5 . . . . 0.0 113.82 173.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.6 t -130.07 135.88 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.106 1.762 . . . . 0.0 109.728 -173.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -80.2 174.77 11.26 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.445 1.498 . . . . 0.0 112.406 177.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.52 -13.31 1.47 Allowed 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 116.279 1.955 . . . . 0.0 116.279 -172.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 9.4 m -151.7 54.54 0.84 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.12 1.768 . . . . 0.0 111.027 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.0 -120.8 5.4 Favored Glycine 0 CA--C 1.527 0.795 0 O-C-N 121.191 -0.943 . . . . 0.0 111.049 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 55.1 -178.81 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.107 0 CA-C-N 118.067 0.933 . . . . 0.0 112.329 -168.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -108.82 123.4 48.99 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.555 -1.341 . . . . 0.0 108.098 166.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.8 mt -87.08 147.79 25.53 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 120.253 1.388 . . . . 0.0 111.06 173.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 42.5 mm -67.67 95.93 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.495 1.118 . . . . 0.0 110.932 -176.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.7 p -136.2 142.78 44.13 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.085 1.354 . . . . 0.0 110.804 173.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.5 ttm180 -68.52 13.13 0.1 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.331 1.452 . . . . 0.0 114.805 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -62.88 -63.44 1.21 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.529 1.531 . . . . 0.0 112.495 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 45.7 pt -55.53 -26.88 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 126.236 1.814 . . . . 0.0 115.644 -169.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -65.79 -33.33 75.61 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.932 -1.105 . . . . 0.0 112.53 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -71.5 -35.44 70.77 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.527 0.731 . . . . 0.0 110.422 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tt -63.99 -49.46 72.4 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.059 1.344 . . . . 0.0 110.595 175.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -58.04 -46.83 84.71 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.047 -0.978 . . . . 0.0 113.154 170.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -64.43 -37.94 89.27 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 120.96 1.709 . . . . 0.0 112.148 -178.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.48 -41.51 89.93 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.473 -0.767 . . . . 0.0 112.361 176.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -89.26 -13.55 37.88 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 67.3 mt -74.64 -35.78 62.87 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.613 1.097 . . . . 0.0 111.455 163.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.9 t . . . . . 0 N--CA 1.471 0.6 0 C-N-CA 123.798 0.839 . . . . 0.0 111.39 170.827 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 21.6 t70 . . . . . 0 N--CA 1.47 0.538 0 CA-C-O 121.489 0.662 . . . . 0.0 111.442 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -72.88 -42.39 63.7 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.496 0.718 . . . . 0.0 111.642 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 57.3 tp -51.45 -59.93 3.7 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.909 0.883 . . . . 0.0 111.875 174.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.7 ppt_? -64.57 -20.95 66.55 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.03 -1.044 . . . . 0.0 113.526 -177.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -74.47 -45.84 43.5 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 124.123 0.889 . . . . 0.0 112.181 169.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -57.43 -50.9 71.53 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 118.962 0.801 . . . . 0.0 112.284 177.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.0 mp -59.79 -41.78 86.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 119.587 1.085 . . . . 0.0 111.598 177.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.07 -32.8 73.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.41 33.06 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.179 -0.951 . . . . 0.0 110.645 175.114 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -71.61 -53.23 14.34 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.257 0.623 . . . . 0.0 112.303 -174.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.1 mt -81.1 166.54 20.61 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.162 0.506 . . . . 0.0 111.566 174.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -85.12 -87.46 0.12 Allowed 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -165.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -143.02 -62.83 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.127 1.371 . . . . 0.0 109.782 169.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -64.54 -37.23 39.03 Favored 'Trans proline' 0 C--N 1.356 0.926 0 CA-C-N 121.993 1.748 . . . . 0.0 112.27 177.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.04 -38.37 65.14 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.028 -1.045 . . . . 0.0 112.529 172.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -49.27 78.42 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.959 1.704 . . . . 0.0 110.557 176.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.8 -32.83 70.83 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 126.771 2.129 . . . . 0.0 114.32 175.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -78.26 -30.59 48.68 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.721 1.26 . . . . 0.0 110.909 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.76 -46.44 62.94 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.841 0.746 . . . . 0.0 111.306 -177.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.8 pp -64.9 -39.36 93.41 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.755 0.422 . . . . 0.0 111.898 174.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.62 -52.69 62.35 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.654 -0.654 . . . . 0.0 112.308 175.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.5 -29.45 69.09 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 117.877 -1.058 . . . . 0.0 111.817 176.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 46.3 ttp -66.65 -50.91 61.42 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.475 1.034 . . . . 0.0 111.771 174.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -67.68 -38.78 84.19 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.301 -0.874 . . . . 0.0 112.127 178.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.18 -41.21 94.84 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.988 1.315 . . . . 0.0 112.016 176.063 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -59.71 -37.51 79.08 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 121.331 -0.856 . . . . 0.0 111.503 172.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 84.1 mt -72.79 -40.98 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 123.834 0.854 . . . . 0.0 112.004 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -57.79 -51.12 70.88 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.528 1.131 . . . . 0.0 111.289 170.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 7.5 m-30 -89.13 11.38 18.75 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.384 1.074 . . . . 0.0 113.289 -176.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt . . . . . 0 N--CA 1.481 1.097 0 C-N-CA 124.355 1.062 . . . . 0.0 112.358 178.725 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.6 t . . . . . 0 CA--C 1.549 0.914 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -65.47 164.6 13.59 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.61 1.564 . . . . 0.0 112.205 177.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.7 p -120.36 156.15 31.93 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.702 1.201 . . . . 0.0 112.517 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.4 t -121.62 128.85 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 125.77 1.628 . . . . 0.0 108.624 -173.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -76.61 179.84 5.73 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.291 1.036 . . . . 0.0 112.636 176.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.73 -29.25 17.78 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 -168.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.3 m -143.55 84.85 1.82 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.654 1.582 . . . . 0.0 109.22 169.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 67.15 -124.3 22.63 Favored Glycine 0 CA--C 1.533 1.199 0 O-C-N 122.07 -0.394 . . . . 0.0 113.086 -177.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 57.31 178.92 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.858 1.263 . . . . 0.0 113.235 -168.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -113.05 125.76 54.74 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 164.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.6 mt -85.7 158.56 20.02 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 118.848 0.749 . . . . 0.0 110.228 169.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 39.8 mm -69.77 119.81 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.421 0.688 . . . . 0.0 110.437 179.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.7 p -147.46 162.16 39.6 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.733 0.813 . . . . 0.0 111.383 177.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -92.05 -19.79 21.98 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.922 -0.486 . . . . 0.0 111.815 -175.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.6 -29.5 37.98 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 173.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.0 mm -55.05 -34.93 33.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 O-C-N 120.794 -1.191 . . . . 0.0 111.433 -177.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -84.77 -18.67 34.33 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 121.171 -0.956 . . . . 0.0 111.613 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -73.77 -30.04 62.54 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.208 0.603 . . . . 0.0 110.501 173.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.8 mp -66.54 -57.01 8.18 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.428 0.558 . . . . 0.0 110.853 171.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -53.66 -46.55 70.63 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.346 177.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -60.66 -40.31 91.59 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.517 1.053 . . . . 0.0 112.715 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.41 -46.29 87.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.139 -0.975 . . . . 0.0 112.333 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -78.78 -21.12 48.3 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.0 mt -69.05 -37.1 78.37 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 119.439 1.018 . . . . 0.0 112.574 171.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.479 1.004 0 CA-C-N 119.152 0.887 . . . . 0.0 112.154 171.824 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 . . . . . 0 CA--C 1.532 0.285 0 CA-C-O 120.487 0.184 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -72.77 -37.6 67.57 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 117.998 -1.001 . . . . 0.0 111.577 -176.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 52.3 tp -54.98 -63.67 1.08 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.524 0.73 . . . . 0.0 111.558 173.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.76 -22.28 66.83 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 117.523 -1.227 . . . . 0.0 113.427 -177.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.92 -44.71 54.23 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 124.21 0.944 . . . . 0.0 112.287 168.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -53.17 -50.53 64.4 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.75 1.22 . . . . 0.0 112.315 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.0 mp -60.72 -39.37 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 O-C-N 121.63 -0.669 . . . . 0.0 111.955 177.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -75.2 -15.95 60.52 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -98.57 -35.39 10.23 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.127 1.371 . . . . 0.0 113.296 175.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -82.91 -39.41 21.53 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.917 0.887 . . . . 0.0 112.214 175.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 83.6 mt -93.95 168.32 11.04 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.387 1.089 . . . . 0.0 112.285 168.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.9 -91.35 0.09 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.63 1.172 . . . . 0.0 112.31 -164.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -146.07 -55.12 0.02 OUTLIER Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.932 1.293 . . . . 0.0 111.281 173.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -68.34 -43.32 4.49 Favored 'Trans proline' 0 C--N 1.356 0.949 0 CA-C-N 121.921 1.722 . . . . 0.0 111.726 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -48.92 -39.47 26.27 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.648 1.579 . . . . 0.0 113.142 173.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.87 -45.13 95.79 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.183 1.393 . . . . 0.0 111.355 176.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.95 -35.17 82.11 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 125.485 1.517 . . . . 0.0 113.707 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -73.73 -32.92 64.1 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.362 1.081 . . . . 0.0 110.68 174.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.09 -45.0 62.35 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.173 0.589 . . . . 0.0 111.565 -176.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.07 -37.06 80.84 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.338 0.655 . . . . 0.0 112.259 175.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.9 -51.51 66.67 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.304 0.502 . . . . 0.0 112.012 173.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.7 mp -58.37 -30.1 66.52 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 117.874 -1.06 . . . . 0.0 111.646 175.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -57.36 10.17 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.067 0.848 . . . . 0.0 111.483 175.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.72 -37.24 84.29 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.215 -0.928 . . . . 0.0 112.395 179.368 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -38.95 92.71 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.189 1.396 . . . . 0.0 112.203 173.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -65.32 -43.19 91.81 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.368 -0.832 . . . . 0.0 111.27 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 55.6 mt -62.43 -38.76 82.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-O 118.406 -0.807 . . . . 0.0 112.419 -178.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -57.2 -23.05 45.17 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.963 0.905 . . . . 0.0 112.786 175.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -118.1 6.6 12.08 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.381 1.472 . . . . 0.0 114.455 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? . . . . . 0 N--CA 1.478 0.935 0 C-N-CA 124.64 1.176 . . . . 0.0 113.857 -176.92 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.4 t . . . . . 0 CA--C 1.54 0.593 0 CA-C-O 122.785 1.279 . . . . 0.0 109.71 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -95.6 161.19 14.15 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 127.399 2.279 . . . . 0.0 112.228 177.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 p -92.23 155.35 18.04 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.597 1.559 . . . . 0.0 113.259 171.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 27.7 m -131.75 159.48 43.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 125.998 1.719 . . . . 0.0 110.438 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -91.35 -178.95 5.27 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.043 1.737 . . . . 0.0 112.715 -177.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.72 15.62 0.1 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.113 1.765 . . . . 0.0 115.528 -173.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.5 m -160.49 38.93 0.17 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.966 2.107 . . . . 0.0 110.547 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.69 -122.51 7.16 Favored Glycine 0 CA--C 1.529 0.961 0 O-C-N 121.035 -1.041 . . . . 0.0 110.981 -166.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 57.07 -174.9 0.07 Allowed 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 118.182 0.991 . . . . 0.0 112.996 -171.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.2 mt -108.58 134.56 51.17 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.942 0.897 . . . . 0.0 108.985 171.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.7 164.3 12.64 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.715 0.806 . . . . 0.0 111.374 175.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 39.3 mm -66.43 108.86 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.025 0.93 . . . . 0.0 111.231 175.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 10.1 t -155.93 162.96 40.31 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.838 1.255 . . . . 0.0 111.675 170.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -94.26 9.09 39.42 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -57.03 -46.14 82.62 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 121.156 -0.965 . . . . 0.0 111.981 172.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.5 pt -56.46 -33.33 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.519 1.128 . . . . 0.0 113.622 178.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 40.0 ttt85 -61.33 -45.1 95.84 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 118.696 0.68 . . . . 0.0 110.706 173.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -68.01 -33.4 74.55 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.153 0.581 . . . . 0.0 111.334 -178.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.3 mp -62.82 -52.56 62.68 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.843 0.747 . . . . 0.0 112.017 168.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.71 -42.9 98.16 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.306 0.957 . . . . 0.0 112.749 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -62.94 -43.88 97.6 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.526 1.057 . . . . 0.0 111.717 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.81 -36.72 79.78 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -90.2 -24.77 20.91 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 31.6 mt -63.59 -44.63 93.46 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 119.308 0.958 . . . . 0.0 111.544 173.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.9 t . . . . . 0 N--CA 1.476 0.833 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 176.58 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.3 t0 . . . . . 0 N--CA 1.468 0.475 0 CA-C-O 121.265 0.555 . . . . 0.0 111.816 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 18.3 mmt85 -64.2 -43.62 94.46 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.112 0.565 . . . . 0.0 110.721 171.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 54.8 tp -56.1 -56.16 24.18 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.434 0.694 . . . . 0.0 112.153 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -55.77 -37.01 67.98 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 119.256 0.935 . . . . 0.0 112.285 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.71 -41.35 92.41 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.807 0.843 . . . . 0.0 112.431 178.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -61.58 -49.04 78.26 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 118.558 -0.734 . . . . 0.0 111.958 173.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.5 mp -57.94 -45.81 87.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.794 1.179 . . . . 0.0 111.195 175.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.84 -32.96 74.9 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -80.64 -45.77 16.7 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.997 0.817 . . . . 0.0 112.708 177.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -66.0 -51.87 54.44 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.993 1.317 . . . . 0.0 112.985 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.9 -160.92 0.15 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.836 1.255 . . . . 0.0 112.102 -178.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.54 -105.48 0.39 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.08 1.352 . . . . 0.0 109.239 173.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 56.7 tt0 -127.54 -64.38 0.02 OUTLIER Pre-proline 0 N--CA 1.468 0.464 0 O-C-N 120.126 -1.609 . . . . 0.0 110.162 -176.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -67.08 -30.95 37.8 Favored 'Trans proline' 0 C--N 1.349 0.574 0 CA-C-N 121.206 1.467 . . . . 0.0 111.561 173.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.6 -35.41 80.41 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 120.794 -1.191 . . . . 0.0 112.267 172.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -64.55 -47.3 79.3 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.971 0.908 . . . . 0.0 110.125 170.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.8 -34.54 78.1 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.138 1.352 . . . . 0.0 114.008 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -33.15 64.84 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.812 1.306 . . . . 0.0 110.041 175.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.38 -43.42 60.62 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.372 0.669 . . . . 0.0 111.558 -174.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -69.49 -35.54 75.67 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.094 0.557 . . . . 0.0 112.439 174.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.84 -50.51 70.65 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 122.937 0.495 . . . . 0.0 111.923 172.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.7 mp -57.79 -31.98 67.1 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 117.619 -1.182 . . . . 0.0 111.916 173.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 2.3 tpt -64.53 -52.32 58.34 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.611 1.096 . . . . 0.0 111.137 174.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 38.3 mm-40 -62.4 -43.08 99.66 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.104 0.562 . . . . 0.0 112.46 177.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -41.82 86.23 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.64 1.176 . . . . 0.0 111.985 -179.405 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -60.88 -42.68 98.4 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.852 0.751 . . . . 0.0 111.332 170.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 68.3 mt -62.5 -28.74 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-O 119.182 -0.437 . . . . 0.0 111.089 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -76.9 -31.21 56.57 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.656 -176.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.3 p90 -102.55 3.31 37.28 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 174.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 9.9 ttpt . . . . . 0 N--CA 1.484 1.251 0 C-N-CA 125.465 1.506 . . . . 0.0 113.585 -179.383 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 CA--C 1.551 1.002 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -67.66 161.88 24.88 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.803 1.241 . . . . 0.0 112.788 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 73.4 p -147.52 163.17 37.41 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.958 0.903 . . . . 0.0 113.201 -178.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.8 p -127.99 130.2 69.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.675 1.59 . . . . 0.0 111.975 -167.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -82.75 178.9 7.96 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.653 1.581 . . . . 0.0 113.336 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.43 -7.01 0.2 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.483 2.313 . . . . 0.0 117.203 -173.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.3 m -161.53 75.84 0.5 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 126.041 1.736 . . . . 0.0 109.864 161.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 73.58 -127.3 10.47 Favored Glycine 0 CA--C 1.528 0.874 0 O-C-N 121.169 -0.957 . . . . 0.0 110.939 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 57.84 175.95 0.05 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.357 1.063 . . . . 0.0 111.372 -166.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.4 125.84 52.2 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.629 -1.294 . . . . 0.0 108.26 167.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.9 mt -84.29 166.33 17.56 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 118.925 0.784 . . . . 0.0 111.959 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 38.2 mm -73.49 94.96 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 124.583 1.153 . . . . 0.0 112.127 -173.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 46.3 p -138.03 148.05 44.74 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.933 1.693 . . . . 0.0 111.58 177.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.31 6.04 48.33 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -174.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -59.48 -39.01 82.37 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.979 0.912 . . . . 0.0 110.906 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 32.8 pt -55.53 -37.09 44.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 125.792 1.637 . . . . 0.0 113.356 176.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 -61.18 -55.22 34.73 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.238 1.015 . . . . 0.0 109.888 176.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -66.48 -31.81 72.78 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.534 0.733 . . . . 0.0 112.305 -179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 8.7 mt -62.51 -53.4 55.26 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.165 0.986 . . . . 0.0 112.497 172.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -59.8 -46.24 89.83 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.68 0.673 . . . . 0.0 110.867 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -65.16 -34.17 77.74 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -177.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.02 -44.7 79.62 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.149 -0.97 . . . . 0.0 112.664 173.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -74.62 -31.22 61.93 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.495 -0.753 . . . . 0.0 112.293 179.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.0 mt -63.49 -39.84 95.5 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.814 0.734 . . . . 0.0 110.465 169.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 172.155 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 110.637 -0.134 . . . . 0.0 110.637 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -57.63 -45.16 85.76 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.872 0.869 . . . . 0.0 111.642 174.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 38.7 tp -62.65 -56.57 16.56 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.515 0.726 . . . . 0.0 112.461 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -22.52 65.54 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.179 -0.951 . . . . 0.0 113.328 -177.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -72.64 -40.17 66.61 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.137 0.975 . . . . 0.0 113.126 174.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -42.9 74.06 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.647 0.658 . . . . 0.0 110.486 177.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 17.8 mt -57.06 -40.97 76.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 121.575 -0.703 . . . . 0.0 110.955 173.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.85 -23.15 64.2 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -79.34 -29.63 42.33 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 174.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -107.37 -37.5 6.21 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -170.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -88.51 156.72 18.93 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.291 1.436 . . . . 0.0 111.664 175.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -75.98 -69.03 0.52 Allowed 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 -157.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -165.21 -56.82 0.01 OUTLIER Pre-proline 0 N--CA 1.479 0.985 0 C-N-CA 127.147 2.179 . . . . 0.0 109.794 168.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -69.78 -39.69 6.16 Favored 'Trans proline' 0 C--N 1.356 0.927 0 CA-C-N 121.446 1.552 . . . . 0.0 111.498 173.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.34 -40.26 61.72 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.75 1.22 . . . . 0.0 112.35 175.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -60.23 -48.36 82.04 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.493 1.517 . . . . 0.0 111.163 174.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.52 -34.05 74.23 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.52 1.533 . . . . 0.0 113.625 177.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -73.83 -34.46 64.56 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.437 1.118 . . . . 0.0 110.906 175.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.78 -46.61 68.29 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 122.876 0.47 . . . . 0.0 110.902 -176.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -71.08 -33.57 70.33 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 175.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.17 -53.02 59.82 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 118.826 0.739 . . . . 0.0 112.257 173.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.16 -34.22 70.06 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.673 0.789 . . . . 0.0 111.242 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 48.3 ttp -64.93 -52.93 53.68 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.601 0.761 . . . . 0.0 112.37 175.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -64.81 -37.64 88.3 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.587 -0.696 . . . . 0.0 112.428 178.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -43.35 94.85 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.344 1.058 . . . . 0.0 112.309 175.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.438 ' O ' ' HE2' ' A' ' 143' ' ' LYS . 73.4 t80 -59.93 -39.47 85.6 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.44 -0.788 . . . . 0.0 111.465 175.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 88.3 mt -72.16 -41.87 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.079 1.351 . . . . 0.0 112.867 176.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -55.0 -53.24 58.26 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.134 1.374 . . . . 0.0 110.028 172.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -79.52 7.93 7.29 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 120.935 -1.103 . . . . 0.0 113.231 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.438 ' HE2' ' O ' ' A' ' 139' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.61 0 C-N-CA 124.093 0.957 . . . . 0.0 112.679 166.77 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.8 t . . . . . 0 N--CA 1.468 0.455 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -169.79 178.09 4.19 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.217 1.807 . . . . 0.0 110.4 -176.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.48 ' HG ' ' CB ' ' A' ' 88' ' ' LEU . 53.9 p -137.11 159.67 41.21 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.739 1.216 . . . . 0.0 112.644 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.0 p -128.33 130.92 69.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 126.52 1.928 . . . . 0.0 111.52 -169.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -77.95 170.03 17.28 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 126.203 1.801 . . . . 0.0 111.644 173.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.34 -1.79 0.15 Allowed 'General case' 0 CA--C 1.558 1.265 0 N-CA-C 117.071 2.248 . . . . 0.0 117.071 -173.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 18.0 m -147.38 39.42 0.99 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.534 1.933 . . . . 0.0 112.094 175.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 86.94 -121.15 5.69 Favored Glycine 0 C--N 1.342 0.913 0 N-CA-C 109.951 -1.259 . . . . 0.0 109.951 -173.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 57.37 175.47 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.091 0.956 . . . . 0.0 112.764 -166.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.44 120.55 42.21 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 164.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.48 ' CB ' ' HG ' ' A' ' 80' ' ' SER . 9.0 mt -84.15 161.0 20.76 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.14 0.882 . . . . 0.0 110.922 170.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 17.9 mt -75.17 99.08 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 124.301 1.04 . . . . 0.0 110.888 -173.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 31.9 p -113.18 155.48 24.94 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.842 0.857 . . . . 0.0 110.595 162.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.524 ' O ' ' HG2' ' A' ' 94' ' ' ARG . 1.5 tpm_? -72.02 -33.08 67.76 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.206 -0.934 . . . . 0.0 111.469 173.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.473 ' HA ' HD21 ' A' ' 95' ' ' ASN . 3.3 m-20 -53.36 -34.55 58.02 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 127.198 2.199 . . . . 0.0 113.447 -167.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 55.3 mt -44.38 -35.97 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 126.424 1.89 . . . . 0.0 112.782 173.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.524 ' HG2' ' O ' ' A' ' 91' ' ' ARG . 19.9 ptt85 -79.9 -24.92 40.8 Favored 'General case' 0 C--N 1.339 0.137 0 O-C-N 121.494 -0.754 . . . . 0.0 111.829 -173.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . 0.473 HD21 ' HA ' ' A' ' 92' ' ' ASP . 68.1 m-80 -73.61 -30.73 63.17 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.175 0.99 . . . . 0.0 110.019 175.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.4 -45.09 89.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.738 0.815 . . . . 0.0 111.425 172.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -60.99 -47.96 84.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 118.127 -0.94 . . . . 0.0 112.715 170.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.7 -41.67 97.9 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 120.355 1.434 . . . . 0.0 112.148 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.24 -22.68 63.33 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 177.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -106.31 -22.49 12.81 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.3 mt -64.05 -51.16 65.43 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.977 1.262 . . . . 0.0 109.833 171.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.8 m . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 172.725 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.7 t70 . . . . . 0 CA--C 1.541 0.633 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 38.8 ptt85 -73.5 -32.37 64.24 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 172.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 43.9 tp -65.23 -58.26 6.4 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.998 0.817 . . . . 0.0 111.013 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.85 -30.81 67.98 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.334 -0.854 . . . . 0.0 112.017 178.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.97 -44.05 81.47 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 122.89 0.476 . . . . 0.0 111.988 174.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -53.36 -56.4 17.03 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.341 1.057 . . . . 0.0 112.049 173.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.2 mp -60.54 -41.03 86.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 121.637 -0.664 . . . . 0.0 111.562 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.18 -24.22 64.94 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.31 -33.2 16.19 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.96 0.904 . . . . 0.0 113.062 173.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.54 -48.84 14.43 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.397 1.479 . . . . 0.0 113.342 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -92.36 155.15 18.1 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.66 1.584 . . . . 0.0 111.049 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -76.42 -74.16 0.24 Allowed 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 114.967 -1.015 . . . . 0.0 113.47 -159.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -158.12 -58.43 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.704 0 C-N-CA 125.102 1.361 . . . . 0.0 110.377 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -70.16 -41.22 3.94 Favored 'Trans proline' 0 C--N 1.353 0.81 0 CA-C-N 121.047 1.41 . . . . 0.0 111.321 171.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.25 -37.47 67.26 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.926 1.29 . . . . 0.0 113.12 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 20.1 ttt-85 -56.59 -50.93 70.52 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.253 1.821 . . . . 0.0 111.104 172.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.72 -30.54 62.8 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.408 1.48 . . . . 0.0 114.376 177.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -80.77 -30.6 36.0 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.412 1.106 . . . . 0.0 111.598 173.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.55 -45.9 64.59 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.635 -0.666 . . . . 0.0 111.043 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -66.34 -34.46 78.03 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.253 0.621 . . . . 0.0 112.638 174.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.0 -54.38 35.26 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.123 0.569 . . . . 0.0 112.124 173.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 65.7 mt -55.31 -38.17 68.34 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.673 0.789 . . . . 0.0 111.051 178.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 60.1 ttp -63.43 -53.79 46.68 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.068 0.947 . . . . 0.0 112.014 177.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -69.71 -32.24 70.71 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.009 -1.057 . . . . 0.0 113.258 -178.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -45.13 95.43 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.679 1.192 . . . . 0.0 110.932 169.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -61.81 -45.08 95.4 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.155 -0.965 . . . . 0.0 111.639 174.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 71.1 mt -61.66 -38.41 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.173 0.989 . . . . 0.0 112.076 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -58.11 -54.74 43.49 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.373 1.469 . . . . 0.0 111.471 173.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -86.01 1.23 51.03 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 120.122 -1.611 . . . . 0.0 113.04 -174.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt . . . . . 0 N--CA 1.474 0.744 0 C-N-CA 124.22 1.008 . . . . 0.0 110.424 173.57 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.3 t . . . . . 0 N--CA 1.477 0.888 0 CA-C-O 121.601 0.715 . . . . 0.0 112.34 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -68.71 168.64 12.81 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.039 1.336 . . . . 0.0 114.205 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.1 p -84.68 162.59 19.64 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.369 1.468 . . . . 0.0 114.032 176.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.3 p -145.28 140.63 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 125.254 1.422 . . . . 0.0 111.122 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -80.96 174.65 11.41 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.459 1.904 . . . . 0.0 111.881 175.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.94 -6.94 0.64 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.71 2.004 . . . . 0.0 115.791 -177.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 26.9 m -156.87 59.34 0.53 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.56 1.944 . . . . 0.0 110.758 169.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.11 -115.98 4.22 Favored Glycine 0 C--N 1.341 0.85 0 O-C-N 121.18 -0.95 . . . . 0.0 111.482 178.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 28.5 m-20 52.36 -177.03 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.748 1.619 . . . . 0.0 113.006 -174.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.4 mt -114.6 119.46 36.84 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 120.342 -1.474 . . . . 0.0 109.777 167.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.8 mt -85.04 149.19 25.75 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.632 0.773 . . . . 0.0 110.246 172.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 15.0 mt -81.77 112.45 19.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 123.525 0.73 . . . . 0.0 110.137 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 6.4 t -155.0 176.51 12.44 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.3 1.04 . . . . 0.0 112.202 169.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -68.31 -15.15 63.46 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -165.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.17 -32.41 73.79 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.751 1.159 . . . . 0.0 112.234 -177.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.7 mt -63.51 -36.47 76.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.384 0.673 . . . . 0.0 111.743 -170.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -59.67 -52.02 67.29 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.619 -0.676 . . . . 0.0 110.494 170.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -62.43 -30.63 71.37 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.32 1.048 . . . . 0.0 112.296 -179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -53.51 56.39 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.087 0.955 . . . . 0.0 111.759 174.067 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -65.62 -43.23 90.19 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.373 176.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -40.06 89.7 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.338 0.972 . . . . 0.0 112.167 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.92 -38.18 84.86 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.51 -0.744 . . . . 0.0 112.586 -178.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -93.28 -21.11 19.79 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 32.1 mt -66.35 -23.35 66.33 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.58 1.082 . . . . 0.0 113.489 173.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 41.6 t . . . . . 0 N--CA 1.473 0.693 0 O-C-N 121.719 -0.613 . . . . 0.0 112.44 164.833 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 . . . . . 0 CA--C 1.529 0.143 0 N-CA-C 110.43 -0.211 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -65.97 -37.45 86.02 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.625 174.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.5 tt -60.74 -65.03 0.75 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.377 0.989 . . . . 0.0 111.018 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.85 -27.61 69.29 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.42 1.088 . . . . 0.0 112.896 -176.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -75.25 -40.27 59.08 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -41.81 95.62 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 174.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 7.4 mt -62.08 -40.39 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.466 -0.771 . . . . 0.0 112.104 172.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.89 -28.0 64.22 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -77.84 -26.29 49.31 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.115 0.966 . . . . 0.0 113.55 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -107.71 -52.88 2.7 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.123 1.369 . . . . 0.0 114.176 -172.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -82.95 130.99 35.2 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.582 -1.324 . . . . 0.0 110.347 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -59.61 -77.27 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 114.287 -1.324 . . . . 0.0 112.881 -158.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -155.47 -61.27 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 125.021 1.328 . . . . 0.0 110.23 174.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -68.52 -37.67 12.51 Favored 'Trans proline' 0 C--N 1.352 0.752 0 CA-C-N 121.501 1.572 . . . . 0.0 110.485 172.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.56 -44.29 65.77 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.145 0.978 . . . . 0.0 111.445 171.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -60.5 -51.47 69.31 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.608 1.963 . . . . 0.0 111.309 178.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -60.69 -30.1 71.58 Favored Glycine 0 CA--C 1.526 0.778 0 C-N-CA 125.387 1.47 . . . . 0.0 114.02 177.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -77.29 -33.7 55.72 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.565 1.183 . . . . 0.0 111.09 172.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.99 -46.15 68.79 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.343 -0.848 . . . . 0.0 111.045 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -69.04 -34.13 74.71 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 176.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.45 -53.16 56.46 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.251 0.621 . . . . 0.0 111.901 172.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.4 mt -55.57 -34.35 64.69 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.074 0.949 . . . . 0.0 111.413 175.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 36.9 ttp -65.86 -53.41 40.19 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 118.634 0.652 . . . . 0.0 112.12 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -59.72 -44.73 93.6 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.701 -0.624 . . . . 0.0 112.56 176.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -45.22 94.32 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.45 1.1 . . . . 0.0 111.389 178.113 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -58.62 -46.32 87.3 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.886 -0.509 . . . . 0.0 111.3 174.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 68.3 mt -61.76 -46.79 95.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 123.741 0.816 . . . . 0.0 111.32 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -65.62 -34.4 78.14 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.948 1.299 . . . . 0.0 112.252 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -91.75 -3.77 55.8 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 176.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt . . . . . 0 N--CA 1.476 0.861 0 O-C-N 120.995 -1.066 . . . . 0.0 113.115 -171.97 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.0 t . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -64.28 158.92 22.05 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.954 1.702 . . . . 0.0 113.915 -175.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.3 p -116.42 165.48 13.17 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -170.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.4 p -140.32 131.84 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 126.702 2.001 . . . . 0.0 111.145 -165.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -81.92 174.21 11.49 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.17 0.988 . . . . 0.0 112.069 172.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.71 -7.95 0.34 Allowed 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 117.136 2.273 . . . . 0.0 117.136 -171.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.4 t -145.84 48.64 1.23 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.716 1.207 . . . . 0.0 111.729 171.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.58 -121.83 5.55 Favored Glycine 0 CA--C 1.528 0.856 0 O-C-N 120.626 -1.296 . . . . 0.0 110.463 -174.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 57.9 -176.69 0.07 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.169 0.988 . . . . 0.0 111.32 -168.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -115.03 119.84 37.84 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.055 -1.028 . . . . 0.0 108.432 170.116 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.2 mt -84.2 135.73 34.25 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 119.156 0.889 . . . . 0.0 110.46 174.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 24.4 mt -66.14 102.14 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 124.265 1.026 . . . . 0.0 109.899 -174.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.6 p -142.46 156.67 45.19 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.228 1.811 . . . . 0.0 110.689 -175.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 30.0 ttt180 -66.38 -21.66 66.23 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -159.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -51.65 -45.73 63.45 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.54 1.536 . . . . 0.0 113.281 -174.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.0 pt -60.32 -28.31 41.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -177.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.3 ttt85 -65.03 -48.42 73.92 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.056 0.844 . . . . 0.0 110.941 173.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -69.88 -33.88 72.82 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.651 0.38 . . . . 0.0 111.885 -179.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.7 mp -56.64 -54.42 46.2 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 118.29 0.496 . . . . 0.0 112.026 171.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -64.46 -39.11 93.2 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.89 -30.82 62.82 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.752 1.16 . . . . 0.0 112.909 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.03 -30.77 71.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 175.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -91.0 -12.43 35.88 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 175.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.9 mt -80.32 -38.89 29.74 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 171.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.6 m . . . . . 0 N--CA 1.448 -0.538 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 178.604 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 t70 . . . . . 0 CA--C 1.543 0.675 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 115' ' ' ARG . 0.7 OUTLIER -76.72 -20.26 56.75 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 119.766 -1.834 . . . . 0.0 111.879 175.099 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.28 -58.0 7.81 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.777 0.431 . . . . 0.0 110.404 171.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -63.42 -32.35 73.76 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 121.169 -0.957 . . . . 0.0 112.744 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.45 -43.29 94.72 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.924 0.89 . . . . 0.0 112.436 176.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.52 -42.01 87.93 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.54 -0.725 . . . . 0.0 110.883 174.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 18.1 mt -56.77 -42.18 76.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 121.715 -0.615 . . . . 0.0 111.483 172.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -66.9 -19.74 65.78 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.73 -9.03 48.19 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.163 1.385 . . . . 0.0 114.652 171.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -125.42 -37.64 2.35 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -173.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -91.22 143.56 26.53 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.854 1.661 . . . . 0.0 110.236 174.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -64.8 -76.09 0.08 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -155.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -158.12 -58.52 0.02 OUTLIER Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 125.197 1.399 . . . . 0.0 109.812 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.3 -41.09 5.19 Favored 'Trans proline' 0 C--N 1.356 0.925 0 CA-C-N 121.411 1.539 . . . . 0.0 111.241 169.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.06 -41.7 65.08 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 120.765 -1.209 . . . . 0.0 112.536 175.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -60.15 -49.66 76.76 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.566 1.546 . . . . 0.0 110.915 173.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.86 -34.26 70.88 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 125.001 1.286 . . . . 0.0 114.196 175.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.11 -33.38 65.53 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.901 1.35 . . . . 0.0 110.201 175.356 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.73 -43.16 56.44 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.298 -0.876 . . . . 0.0 111.811 -174.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -68.36 -35.74 78.19 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 119.137 -0.458 . . . . 0.0 112.223 174.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.18 -50.21 74.06 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.643 0.656 . . . . 0.0 111.523 172.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.7 mp -56.39 -34.97 67.23 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.268 1.027 . . . . 0.0 112.149 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 3.3 tpt -65.09 -47.01 78.74 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.039 0.836 . . . . 0.0 111.74 177.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -67.06 -42.35 84.91 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.723 -0.611 . . . . 0.0 111.881 176.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -38.93 93.06 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.129 1.372 . . . . 0.0 112.371 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -63.81 -33.75 76.37 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.625 -1.297 . . . . 0.0 112.117 174.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 81.9 mt -77.04 -36.41 24.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.821 1.248 . . . . 0.0 111.589 175.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . 0.599 ' O ' ' OD1' ' A' ' 141' ' ' ASP . 34.0 t0 -68.57 -30.28 69.02 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 120.869 -1.144 . . . . 0.0 110.365 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -96.99 10.03 40.35 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 173.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? . . . . . 0 N--CA 1.481 1.092 0 O-C-N 120.382 -1.449 . . . . 0.0 113.094 177.371 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.8 t . . . . . 0 CA--C 1.541 0.625 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -62.75 153.45 32.75 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.92 0.888 . . . . 0.0 111.652 173.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.8 p -118.4 159.57 23.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.917 0.865 . . . . 0.0 112.272 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.7 t -118.31 124.8 73.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 C-N-CA 126.446 1.898 . . . . 0.0 107.43 -172.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -79.08 -177.22 5.5 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.116 1.366 . . . . 0.0 110.605 176.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.29 -21.26 5.26 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -174.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.33 52.86 1.27 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.242 1.017 . . . . 0.0 112.333 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.75 -120.24 5.18 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 120.674 -1.266 . . . . 0.0 111.722 -170.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 60.18 171.57 0.09 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.505 1.122 . . . . 0.0 113.42 -173.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.35 111.88 23.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.379 -0.826 . . . . 0.0 109.949 172.366 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.5 mt -79.48 153.46 29.59 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 122.964 1.364 . . . . 0.0 112.769 176.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 18.2 mt -57.62 118.69 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.592 1.157 . . . . 0.0 110.338 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.9 p -146.93 130.39 16.75 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.983 0.913 . . . . 0.0 112.068 177.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -69.65 -14.21 62.7 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 120.868 -1.145 . . . . 0.0 113.223 -176.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -76.33 -15.75 59.9 Favored 'General case' 0 N--CA 1.455 -0.197 0 O-C-N 121.14 -0.975 . . . . 0.0 111.985 -177.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.3 -39.51 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.513 0.725 . . . . 0.0 112.4 174.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -64.14 -40.53 96.37 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 120.752 -1.217 . . . . 0.0 112.444 178.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -67.33 -30.4 70.21 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.372 1.069 . . . . 0.0 111.516 178.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -51.93 67.92 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.247 1.019 . . . . 0.0 111.605 172.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -67.34 -39.92 85.82 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.743 -0.646 . . . . 0.0 111.241 179.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.58 -45.46 93.88 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.13 0.972 . . . . 0.0 112.795 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.34 69.29 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -99.62 -14.84 18.8 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.966 0.906 . . . . 0.0 112.702 174.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.4 mt -70.98 -43.86 67.18 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.454 1.102 . . . . 0.0 112.442 171.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.485 1.297 0 CA-C-N 120.553 1.524 . . . . 0.0 112.081 172.861 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.468 0.461 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -67.82 -30.48 69.89 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 173.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.55 -63.92 1.04 Allowed 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.572 1.149 . . . . 0.0 111.751 -174.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -23.79 62.02 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 117.819 -1.086 . . . . 0.0 113.605 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.98 -50.33 66.78 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.519 0.728 . . . . 0.0 111.742 170.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.93 -47.7 84.1 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.895 0.771 . . . . 0.0 111.459 172.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 60.9 mt -56.32 -44.85 80.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.987 0.812 . . . . 0.0 110.836 179.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -76.19 -18.35 59.11 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -86.46 -6.26 58.95 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 173.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.529 ' OE2' ' HA ' ' A' ' 123' ' ' GLU . 27.9 mm-40 -128.49 -37.33 1.81 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -174.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.5 mp -80.69 162.14 24.29 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.137 0.494 . . . . 0.0 110.378 166.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -82.9 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.188 0 CA-C-O 121.921 0.867 . . . . 0.0 113.195 -174.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -164.98 -61.41 0.01 OUTLIER Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.443 1.497 . . . . 0.0 109.528 -178.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.1 -42.95 26.58 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.286 1.324 . . . . 0.0 110.906 173.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.5 -40.74 75.48 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.273 1.029 . . . . 0.0 112.724 177.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -60.76 -41.7 96.0 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.235 1.014 . . . . 0.0 110.568 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -56.58 -39.9 86.31 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 124.421 1.01 . . . . 0.0 113.909 174.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -72.03 -38.44 69.56 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.08 0.94 . . . . 0.0 112.972 171.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.62 -50.17 73.66 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 121.352 1.887 . . . . 0.0 112.578 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.1 pp -66.58 -33.57 75.96 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 176.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.39 -50.81 70.04 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.341 -0.849 . . . . 0.0 112.02 171.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 83.2 mt -58.45 -30.78 67.21 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.441 1.019 . . . . 0.0 111.726 176.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 7.6 ttp -63.62 -64.34 0.92 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.225 1.41 . . . . 0.0 111.963 172.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -64.14 -29.32 70.45 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.872 -1.142 . . . . 0.0 112.44 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.84 -46.62 87.07 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.457 1.903 . . . . 0.0 113.269 171.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.541 ' C ' ' CD1' ' A' ' 139' ' ' TYR . 0.5 OUTLIER -75.88 -22.28 56.32 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 118.145 -1.422 . . . . 0.0 109.873 -177.367 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 69.1 mt -71.58 -45.13 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.023 171.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -58.55 -45.23 89.37 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.482 1.513 . . . . 0.0 110.395 175.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -93.67 15.65 15.78 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.291 1.037 . . . . 0.0 113.588 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? . . . . . 0 N--CA 1.487 1.406 0 O-C-N 120.271 -1.518 . . . . 0.0 111.476 -178.953 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 121.147 0.499 . . . . 0.0 111.59 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -56.27 148.74 17.79 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.299 1.04 . . . . 0.0 112.524 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.6 p -125.32 161.2 27.52 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.716 1.246 . . . . 0.0 113.476 -170.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.5 m -138.46 149.11 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 126.103 1.761 . . . . 0.0 109.838 -175.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -79.5 177.98 8.46 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 124.354 1.061 . . . . 0.0 111.843 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.19 13.1 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 128.32 2.648 . . . . 0.0 116.767 -177.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.8 m -156.92 30.43 0.31 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.661 1.984 . . . . 0.0 111.355 169.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.1 -127.48 8.69 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 120.557 -1.339 . . . . 0.0 112.219 -173.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 57.09 -170.34 0.1 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.426 1.09 . . . . 0.0 112.282 -167.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.35 116.53 26.39 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.438 -0.789 . . . . 0.0 109.823 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mt -88.64 158.02 18.37 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 123.032 1.396 . . . . 0.0 112.884 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 14.2 mt -80.2 95.11 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 124.462 1.105 . . . . 0.0 110.065 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . 0.256 8.1 t -119.45 3.92 11.22 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.006 1.323 . . . . 0.0 113.731 174.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 15.2 ttm105 65.94 -17.75 0.11 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 126.19 1.796 . . . . 0.0 115.42 -177.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -43.01 -47.02 5.71 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.862 1.665 . . . . 0.0 114.814 176.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 48.9 pt -57.18 -27.72 28.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -176.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -70.2 -48.78 55.64 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.158 0.89 . . . . 0.0 110.977 175.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -60.66 -34.4 74.26 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.38 0.672 . . . . 0.0 111.382 173.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 tt -64.09 -49.21 73.16 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.256 1.022 . . . . 0.0 111.864 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -62.8 -44.28 96.58 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.231 0.923 . . . . 0.0 112.711 171.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.11 -42.03 76.18 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.685 1.13 . . . . 0.0 112.308 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.28 -46.25 91.1 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.455 -0.778 . . . . 0.0 112.367 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -78.63 -21.38 48.51 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.7 mt -73.02 -48.33 37.19 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 118.731 0.696 . . . . 0.0 112.145 170.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 13.5 t . . . . . 0 N--CA 1.476 0.835 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -174.091 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 38.1 t70 . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 121.689 0.757 . . . . 0.0 111.544 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.84 -43.01 63.16 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.887 1.275 . . . . 0.0 111.907 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 52.4 tp -57.11 -53.36 58.96 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.459 1.104 . . . . 0.0 111.94 178.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -62.88 -30.13 71.29 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.504 -0.748 . . . . 0.0 112.567 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.94 -40.46 63.06 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.211 1.004 . . . . 0.0 111.617 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.0 -39.39 79.36 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.387 0.675 . . . . 0.0 111.066 175.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 17.0 mt -61.62 -43.32 96.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 O-C-N 121.302 -0.874 . . . . 0.0 111.175 172.284 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.65 -25.17 63.79 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -80.91 -36.87 30.57 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 174.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -93.98 -34.35 13.09 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -175.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 27.5 mt -81.28 170.95 15.43 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.448 1.022 . . . . 0.0 112.41 173.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.96 -78.18 0.2 Allowed 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.693 -0.63 . . . . 0.0 112.101 -167.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -162.05 -63.37 0.02 OUTLIER Pre-proline 0 CA--C 1.543 0.683 0 C-N-CA 125.581 1.553 . . . . 0.0 109.291 174.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -64.52 -37.19 39.39 Favored 'Trans proline' 0 C--N 1.356 0.922 0 CA-C-N 121.156 1.449 . . . . 0.0 111.126 174.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.27 -41.18 62.64 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.403 1.081 . . . . 0.0 112.889 172.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 8.6 ttt180 -63.39 -49.18 74.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.372 1.069 . . . . 0.0 110.587 175.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.71 -31.77 72.3 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.564 1.078 . . . . 0.0 113.894 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -77.22 -32.97 56.25 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.511 1.155 . . . . 0.0 110.95 173.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.22 -46.59 60.85 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.483 -0.761 . . . . 0.0 110.958 -175.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -66.31 -37.96 86.61 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.133 0.573 . . . . 0.0 112.45 174.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.24 -53.58 55.02 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.85 0.75 . . . . 0.0 111.711 176.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 93.0 mt -59.66 -32.51 70.54 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 118.364 -0.827 . . . . 0.0 111.405 177.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 45.9 ttp -66.66 -51.63 53.95 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.558 0.743 . . . . 0.0 112.652 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -65.68 -40.16 92.06 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.302 -0.874 . . . . 0.0 111.763 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -44.4 97.06 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.605 1.162 . . . . 0.0 111.475 174.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -60.18 -47.08 87.46 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.646 -0.659 . . . . 0.0 111.317 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 65.1 mt -59.98 -39.68 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.623 0.769 . . . . 0.0 111.198 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -61.66 -43.23 99.26 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -92.09 6.57 46.0 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? . . . . . 0 N--CA 1.478 0.958 0 C-N-CA 125.262 1.425 . . . . 0.0 112.743 174.12 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 7.9 t-160 . . . . . 0 CA--C 1.55 0.965 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 90.0 mt -137.01 80.25 36.12 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.541 1.536 . . . . 0.0 111.127 176.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -73.22 168.44 24.74 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.221 3.28 . . . . 0.0 113.209 174.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 80.7 p -88.1 175.82 7.56 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.34 1.456 . . . . 0.0 114.356 -174.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.4 p -60.2 149.06 34.19 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -77.1 -6.02 51.22 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.953 1.464 . . . . 0.0 114.953 -174.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.56 -38.7 0.4 Allowed 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 -169.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 70.04 5.95 54.87 Favored Glycine 0 CA--C 1.54 1.639 0 N-CA-C 116.054 1.182 . . . . 0.0 116.054 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.2 p -63.22 -29.45 70.78 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 119.282 1.541 . . . . 0.0 113.357 178.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.2 t -156.09 -175.64 5.54 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.97 1.708 . . . . 0.0 110.264 -173.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.1 m -105.35 165.51 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.969 1.307 . . . . 0.0 112.109 176.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 -121.34 80.88 1.72 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.707 2.003 . . . . 0.0 108.3 175.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 132.24 76.16 0.12 Allowed Glycine 0 N--CA 1.47 0.95 0 C-N-CA 123.835 0.731 . . . . 0.0 113.526 -179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.498 ' H ' ' CG ' ' A' ' 92' ' ' ASP . 1.7 t -145.52 20.54 1.51 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.601 2.36 . . . . 0.0 112.081 173.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -59.19 161.88 4.98 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.606 1.963 . . . . 0.0 112.369 172.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.9 p -114.27 165.66 12.45 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.3 1.048 . . . . 0.0 113.648 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.2 p -128.83 130.84 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 126.931 2.093 . . . . 0.0 109.961 -172.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -77.99 173.7 11.9 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.519 1.128 . . . . 0.0 111.477 174.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.01 3.96 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 127.617 2.367 . . . . 0.0 116.403 -173.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 15.2 m -152.55 30.41 0.53 Allowed 'General case' 0 N--CA 1.471 0.591 0 O-C-N 119.896 -1.753 . . . . 0.0 112.517 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 92.09 -128.17 9.26 Favored Glycine 0 CA--C 1.528 0.901 0 O-C-N 120.631 -1.293 . . . . 0.0 110.51 -167.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 57.08 172.74 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.821 1.248 . . . . 0.0 112.989 -169.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.3 122.16 43.19 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 120.977 -1.077 . . . . 0.0 109.321 172.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.7 mt -88.37 143.89 26.73 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 120.223 1.374 . . . . 0.0 111.622 173.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.5 mt -63.4 109.82 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.931 1.292 . . . . 0.0 110.037 -176.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 p -149.37 143.29 25.67 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.302 1.441 . . . . 0.0 110.847 -173.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 32.5 ttt-85 -71.65 -13.57 61.79 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -175.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.498 ' CG ' ' H ' ' A' ' 78' ' ' SER . 32.4 t70 -51.98 -40.47 60.99 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.699 1.2 . . . . 0.0 112.294 171.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 67.1 mt -54.55 -33.95 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.158 0.983 . . . . 0.0 111.572 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 40.1 ttt85 -83.38 -32.4 26.22 Favored 'General case' 0 N--CA 1.456 -0.144 0 O-C-N 120.941 -1.099 . . . . 0.0 111.686 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -61.98 -35.06 77.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.472 -0.142 . . . . 0.0 111.189 170.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.4 -52.84 56.17 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.144 1.378 . . . . 0.0 111.641 177.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -61.74 -46.0 91.53 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.652 -0.655 . . . . 0.0 112.322 172.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -59.77 -41.42 91.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.305 0.957 . . . . 0.0 112.346 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.92 -43.66 98.39 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.695 -0.628 . . . . 0.0 111.608 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -85.66 -12.88 50.19 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.4 mt -73.22 -40.05 65.01 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.635 1.107 . . . . 0.0 111.97 170.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.9 m -78.63 -36.82 43.51 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 171.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -78.58 8.21 5.6 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 173.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 4.2 p -61.78 -32.7 54.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -166.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 74.72 126.49 0.16 Allowed Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.323 0.963 . . . . 0.0 112.886 -174.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.96 -59.81 2.53 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.713 -0.875 . . . . 0.0 111.359 176.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -78.51 -47.68 1.9 Allowed Pre-proline 0 CA--C 1.551 0.991 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 177.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -79.49 16.99 1.31 Allowed 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.819 3.013 . . . . 0.0 114.645 -178.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 45.7 tp -41.69 -39.61 1.73 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 127.976 2.51 . . . . 0.0 115.534 -172.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -63.03 -31.02 72.07 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -178.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -82.86 -42.07 18.23 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 118.91 0.777 . . . . 0.0 111.871 -178.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.1 m -58.19 -43.08 87.36 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.173 0.989 . . . . 0.0 112.045 -176.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.1 pp -67.6 -33.32 74.77 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 122.949 0.499 . . . . 0.0 111.959 176.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -72.17 -38.0 69.23 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.346 0.658 . . . . 0.0 111.269 -176.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -70.09 -43.85 70.24 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.207 -0.933 . . . . 0.0 111.929 169.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 54.5 tp -51.13 -61.62 2.12 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.677 0.791 . . . . 0.0 111.44 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.8 ppt_? -60.13 -28.24 67.72 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.847 0.859 . . . . 0.0 112.763 -178.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.76 -41.82 74.67 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 173.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -59.79 -47.84 84.08 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.096 0.862 . . . . 0.0 112.163 176.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.1 mp -60.1 -42.66 90.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 118.517 0.599 . . . . 0.0 111.088 176.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.54 -23.49 65.44 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.42 -50.55 5.89 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.71 0.804 . . . . 0.0 112.735 174.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -76.94 -38.48 53.27 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.416 -1.427 . . . . 0.0 113.206 -170.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.66 -172.33 0.35 Allowed 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 120.199 1.363 . . . . 0.0 111.567 171.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -97.5 -120.34 0.13 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.632 1.173 . . . . 0.0 110.109 169.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.421 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 20.5 tt0 -120.26 -63.86 0.03 OUTLIER Pre-proline 0 CA--C 1.536 0.423 0 C-N-CA 125.699 1.6 . . . . 0.0 108.448 -172.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . 0.421 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.9 Cg_endo -67.22 -36.3 21.76 Favored 'Trans proline' 0 C--N 1.351 0.675 0 CA-C-N 120.641 1.265 . . . . 0.0 111.307 174.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.74 -34.25 72.71 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 120.833 -1.167 . . . . 0.0 112.477 176.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 19.0 ttt180 -63.09 -48.77 77.17 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.279 1.031 . . . . 0.0 110.434 172.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.14 -34.57 80.21 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 124.729 1.157 . . . . 0.0 113.514 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -75.25 -33.04 61.26 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 118.38 1.09 . . . . 0.0 111.171 174.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.03 -44.93 62.61 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.212 0.605 . . . . 0.0 111.132 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.35 -37.05 80.12 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.252 0.621 . . . . 0.0 112.365 174.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.22 -55.49 24.54 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 118.387 0.54 . . . . 0.0 111.696 175.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.8 mp -56.9 -30.47 63.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.2 175.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 9.3 tmm? -67.34 -52.05 44.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.215 0.916 . . . . 0.0 111.673 176.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -67.37 -38.33 84.6 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.45 -0.781 . . . . 0.0 112.583 177.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.11 -34.96 73.77 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.529 1.532 . . . . 0.0 112.224 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -63.13 -46.94 84.9 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.115 -0.99 . . . . 0.0 110.3 168.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 78.2 mt -60.58 -34.94 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.588 0.755 . . . . 0.0 112.269 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.468 ' O ' ' OD1' ' A' ' 141' ' ' ASP . 48.4 t0 -67.37 -25.3 65.9 Favored 'General case' 0 C--N 1.34 0.177 0 C-N-CA 124.101 0.96 . . . . 0.0 111.63 -177.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -113.21 5.81 17.16 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? -74.64 -25.9 59.52 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.675 -1.265 . . . . 0.0 112.94 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -88.02 135.39 33.44 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.527 1.931 . . . . 0.0 110.829 174.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -79.31 43.67 0.55 Allowed 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 -178.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 CA--C 1.549 0.907 0 C-N-CA 125.79 1.636 . . . . 0.0 113.489 171.956 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 . . . . . 0 CA--C 1.549 0.929 0 CA-C-O 121.622 0.725 . . . . 0.0 112.132 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 73.9 mt -64.21 149.2 94.7 Favored Pre-proline 0 CA--C 1.543 0.71 0 C-N-CA 124.556 1.143 . . . . 0.0 111.696 175.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -63.61 148.97 92.03 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 122.685 2.257 . . . . 0.0 112.658 176.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.0 p -77.81 -176.4 4.4 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.501 1.92 . . . . 0.0 113.44 -174.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.3 p -74.33 -163.73 0.21 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.643 0.777 . . . . 0.0 111.853 164.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -59.8 160.19 7.88 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.754 1.621 . . . . 0.0 113.902 -176.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 6.4 mtp180 -63.54 130.07 42.83 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 121.129 -0.982 . . . . 0.0 111.832 178.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 129.99 -150.43 19.09 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.61 1.1 . . . . 0.0 111.506 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.9 t -73.27 -178.52 2.97 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.398 0.679 . . . . 0.0 111.861 171.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 50.8 m -63.78 166.66 6.86 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.99 1.316 . . . . 0.0 113.429 177.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.3 m -56.09 134.07 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.77 0.828 . . . . 0.0 111.205 175.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -82.92 50.65 1.76 Allowed 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -168.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.24 119.76 16.28 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 123.744 0.687 . . . . 0.0 112.989 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.451 ' H ' ' CG ' ' A' ' 92' ' ' ASP . 2.9 t -142.81 28.16 1.6 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.693 1.997 . . . . 0.0 112.045 -175.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -68.8 165.75 19.04 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.44 -1.413 . . . . 0.0 111.043 165.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.5 p -134.43 160.33 38.33 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.729 0.776 . . . . 0.0 112.335 175.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.4 t -122.76 128.13 75.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 125.927 1.691 . . . . 0.0 108.193 -169.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -81.84 177.1 9.07 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.561 1.144 . . . . 0.0 112.726 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.93 -19.15 1.63 Allowed 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -170.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.5 m -134.69 29.93 3.48 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.039 1.336 . . . . 0.0 112.434 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 96.21 -123.12 7.59 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -171.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 50.1 m-20 59.22 178.62 0.08 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.66 1.184 . . . . 0.0 114.067 -176.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.12 127.37 54.11 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.369 -0.832 . . . . 0.0 109.114 168.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.8 mt -93.22 149.75 21.0 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 122.117 0.961 . . . . 0.0 110.957 168.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 16.7 mt -79.75 99.74 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 O-C-N 121.447 -0.783 . . . . 0.0 110.625 -173.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 30.1 p -118.28 -1.48 11.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.254 1.022 . . . . 0.0 113.398 170.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 64.95 -0.31 1.05 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.152 1.781 . . . . 0.0 115.389 -175.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.451 ' CG ' ' H ' ' A' ' 78' ' ' SER . 29.5 t70 -50.06 -49.5 51.05 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.843 1.657 . . . . 0.0 114.718 178.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.2 pt -52.6 -25.86 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 N-CA-C 113.72 1.008 . . . . 0.0 113.72 -176.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -61.66 -45.59 93.36 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.672 1.124 . . . . 0.0 112.145 171.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -58.29 -40.71 82.67 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.054 0.843 . . . . 0.0 111.637 173.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.47 -39.65 85.29 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.554 0.742 . . . . 0.0 111.983 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -70.88 -43.63 67.99 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.092 0.86 . . . . 0.0 112.603 171.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -59.14 -36.84 75.96 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.4 1.08 . . . . 0.0 112.234 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.89 -24.17 67.45 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 175.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -111.04 -11.78 14.26 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.429 1.092 . . . . 0.0 113.641 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.4 mt -75.93 -33.82 59.87 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.302 1.041 . . . . 0.0 111.008 167.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.4 p -74.97 -42.15 58.17 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.553 1.141 . . . . 0.0 112.13 170.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -90.84 26.22 2.14 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.199 1.4 . . . . 0.0 114.233 176.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 8.7 p -56.81 -29.35 30.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -165.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 133.89 119.75 2.02 Favored Glycine 0 N--CA 1.468 0.785 0 O-C-N 121.185 -0.947 . . . . 0.0 113.077 169.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -69.34 -33.62 73.39 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 114.109 1.151 . . . . 0.0 114.109 -178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -146.32 -54.44 0.02 OUTLIER Pre-proline 0 N--CA 1.478 0.974 0 C-N-CA 126.164 1.785 . . . . 0.0 112.722 179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -79.65 58.6 7.04 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 123.644 2.896 . . . . 0.0 112.821 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.39 -42.02 61.11 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.43 1.492 . . . . 0.0 112.12 -177.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 67.3 mm-40 -60.83 -20.59 61.98 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.742 1.217 . . . . 0.0 113.71 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -96.08 -24.39 16.34 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.609 1.164 . . . . 0.0 113.353 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.1 m -61.27 -49.32 77.53 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.538 -1.351 . . . . 0.0 110.43 167.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.3 pp -68.39 -31.15 70.3 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 118.355 -0.831 . . . . 0.0 112.761 -177.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.2 -49.27 78.31 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.407 0.683 . . . . 0.0 110.939 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 85.2 mtm180 -65.37 -46.62 79.42 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.475 1.11 . . . . 0.0 111.007 176.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.1 tt -51.05 -64.01 0.95 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.626 1.17 . . . . 0.0 111.4 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -32.48 68.54 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.561 1.144 . . . . 0.0 112.809 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.87 87.38 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.904 -0.569 . . . . 0.0 112.127 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -60.79 -47.85 84.45 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.781 0.719 . . . . 0.0 112.116 176.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.3 mp -63.15 -45.03 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.155 0.889 . . . . 0.0 111.348 176.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.79 -29.74 69.01 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -179.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.67 -65.83 0.74 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.812 0.845 . . . . 0.0 110.899 172.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -70.72 -46.08 63.73 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.304 1.441 . . . . 0.0 113.403 -169.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 6.8 mp -78.58 164.13 24.93 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 120.727 -1.233 . . . . 0.0 109.809 168.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -79.09 -93.47 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.499 0.72 . . . . 0.0 112.329 -165.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -146.92 -54.6 0.02 OUTLIER Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 124.962 1.305 . . . . 0.0 111.198 175.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -70.84 -38.89 4.91 Favored 'Trans proline' 0 C--N 1.354 0.84 0 CA-C-N 121.449 1.553 . . . . 0.0 111.004 171.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.69 -42.08 64.46 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.221 1.408 . . . . 0.0 112.678 177.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -56.36 -49.29 74.82 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.766 2.026 . . . . 0.0 111.19 173.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.22 -34.38 67.13 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 125.151 1.357 . . . . 0.0 113.798 176.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -76.79 -31.19 56.83 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.457 1.128 . . . . 0.0 110.92 175.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.2 -50.98 50.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 122.87 0.468 . . . . 0.0 110.36 -178.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.7 pp -66.34 -35.77 81.21 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 177.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.65 -53.11 56.51 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.603 0.638 . . . . 0.0 112.019 174.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.67 -27.57 68.78 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 117.655 -1.164 . . . . 0.0 111.692 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -64.93 -53.09 51.86 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.866 1.212 . . . . 0.0 111.677 173.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -64.31 -41.45 96.84 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 177.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -68.41 -40.39 81.28 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.011 1.324 . . . . 0.0 112.671 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -58.19 -38.51 76.87 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.201 -0.937 . . . . 0.0 111.157 169.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 86.4 mt -71.23 -44.43 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 123.712 0.805 . . . . 0.0 112.387 177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -54.44 -31.43 55.39 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.608 1.563 . . . . 0.0 111.466 174.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -106.34 3.93 28.06 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 178.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -72.44 -25.72 61.56 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 125.022 1.329 . . . . 0.0 112.875 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -98.75 135.92 39.53 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.969 0.908 . . . . 0.0 109.995 -177.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 24.0 pt-20 -72.59 28.13 0.06 Allowed 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.846 1.658 . . . . 0.0 114.553 178.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 50.1 mt . . . . . 0 CA--C 1.545 0.773 0 C-N-CA 130.115 3.366 . . . . 0.0 117.032 -177.266 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 9.7 m170 . . . . . 0 N--CA 1.468 0.464 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.9 tp 46.87 62.14 12.25 Favored Pre-proline 0 CA--C 1.558 1.277 0 C-N-CA 125.876 1.67 . . . . 0.0 113.786 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -62.79 130.88 30.92 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 122.583 2.189 . . . . 0.0 111.292 -178.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.2 p -141.27 107.02 5.11 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.433 1.493 . . . . 0.0 110.554 -163.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 59.0 p -135.7 39.95 2.79 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -169.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 30.3 p90 -68.82 22.0 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 128.037 2.535 . . . . 0.0 116.38 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -70.77 170.35 12.64 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.575 1.55 . . . . 0.0 113.591 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 121.02 -177.5 16.38 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 125.476 1.513 . . . . 0.0 112.159 -174.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.5 t -68.37 148.43 50.71 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 122.149 -0.618 . . . . 0.0 110.619 166.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.4 t 57.27 62.88 2.04 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 -177.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 8.7 m -57.8 163.55 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.294 1.038 . . . . 0.0 112.561 171.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -30.93 -63.22 0.15 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.473 1.909 . . . . 0.0 115.723 178.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 117.16 140.55 6.7 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 122.939 1.3 . . . . 0.0 112.611 -173.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.9 t -78.95 92.11 4.9 Favored 'General case' 0 C--O 1.238 0.487 0 O-C-N 121.613 -0.934 . . . . 0.0 109.701 173.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -53.48 154.96 3.18 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.435 1.112 . . . . 0.0 111.711 175.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 5.9 p -114.2 157.88 22.09 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.204 1.402 . . . . 0.0 111.722 -175.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.5 t -129.48 128.23 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 125.505 1.522 . . . . 0.0 107.478 -172.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -81.54 -175.17 5.38 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.736 0.814 . . . . 0.0 111.293 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.39 -21.0 8.44 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -172.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -144.73 50.79 1.26 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.291 1.036 . . . . 0.0 112.334 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.07 -122.82 5.84 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 120.376 -1.452 . . . . 0.0 110.826 -169.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 60.31 172.0 0.09 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.338 1.055 . . . . 0.0 112.964 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.59 119.14 38.65 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 170.29 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.62 143.52 38.17 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-O 121.568 0.699 . . . . 0.0 110.12 173.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 48.0 mm -73.23 108.33 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 O-C-N 121.56 -0.712 . . . . 0.0 109.932 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.2 p -152.32 158.24 42.47 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.991 1.316 . . . . 0.0 112.392 177.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -57.93 -14.23 5.9 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.488 1.515 . . . . 0.0 114.494 -174.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -66.15 -28.79 69.06 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 122.47 0.308 . . . . 0.0 111.7 -178.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.51 -53.99 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 121.285 0.564 . . . . 0.0 111.662 178.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -72.28 -28.75 63.31 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 118.587 -0.72 . . . . 0.0 112.818 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.48 -40.11 73.81 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.75 174.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.07 -51.25 58.78 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.819 1.247 . . . . 0.0 111.606 170.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -66.0 -36.12 82.42 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.034 -1.041 . . . . 0.0 112.056 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.57 -48.13 80.81 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.982 1.264 . . . . 0.0 111.306 173.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.44 -35.32 75.54 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.99 0.916 . . . . 0.0 112.644 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -91.04 -17.09 26.83 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.9 mt -72.98 -34.95 66.77 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 120.605 -1.31 . . . . 0.0 113.019 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.6 t -82.22 -5.21 58.34 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.339 0.972 . . . . 0.0 113.096 175.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -83.13 -2.55 55.73 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 124.762 1.225 . . . . 0.0 114.242 173.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 3.8 p -88.63 -5.61 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -175.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -73.76 -7.26 74.49 Favored Glycine 0 CA--C 1.541 1.691 0 O-C-N 120.182 -1.573 . . . . 0.0 113.979 175.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -115.97 -60.17 1.9 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.177 1.791 . . . . 0.0 112.197 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.422 ' OE2' ' NH1' ' A' ' 115' ' ' ARG . 13.4 mt-10 -93.96 151.51 39.82 Favored Pre-proline 0 CA--C 1.542 0.655 0 N-CA-C 113.734 1.012 . . . . 0.0 113.734 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -68.86 150.63 73.74 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.764 2.309 . . . . 0.0 111.236 173.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -51.45 -37.54 49.29 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-N 115.11 -0.95 . . . . 0.0 113.293 -179.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -45.88 81.16 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 117.63 -1.176 . . . . 0.0 112.472 177.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -80.36 -37.94 31.43 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 120.358 1.436 . . . . 0.0 113.435 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.0 p -63.9 -40.53 96.73 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.221 0.919 . . . . 0.0 111.575 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.45 -36.72 76.88 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-O 117.783 -1.103 . . . . 0.0 111.962 173.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -55.67 -42.22 74.81 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.33 0.968 . . . . 0.0 110.524 -174.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.422 ' NH1' ' OE2' ' A' ' 107' ' ' GLU . 82.0 mtt180 -78.03 -41.29 36.17 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.767 0.827 . . . . 0.0 111.167 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 33.2 tp -55.99 -59.77 4.43 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.966 0.412 . . . . 0.0 111.994 177.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -24.83 64.44 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.349 -0.834 . . . . 0.0 113.002 -178.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.48 -51.27 53.34 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.864 0.756 . . . . 0.0 111.842 170.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -51.06 69.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.551 0.74 . . . . 0.0 110.812 173.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 62.1 mt -55.45 -43.7 73.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 O-C-N 121.7 -0.625 . . . . 0.0 111.461 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -77.8 -24.66 48.75 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -75.73 -42.54 50.41 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.606 0.763 . . . . 0.0 110.056 172.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -76.74 -61.13 2.07 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 124.598 1.159 . . . . 0.0 112.9 -178.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 57.5 mt -60.38 171.9 0.97 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.926 1.239 . . . . 0.0 112.221 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 10.8 tp-100 -71.48 -88.99 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.857 0.863 . . . . 0.0 111.936 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -166.13 -59.19 0.01 OUTLIER Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 125.645 1.578 . . . . 0.0 109.432 -172.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -63.2 -44.49 15.04 Favored 'Trans proline' 0 C--N 1.359 1.104 0 CA-C-N 120.357 1.163 . . . . 0.0 110.748 171.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.27 -37.54 75.17 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.435 1.094 . . . . 0.0 112.772 177.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 14.1 ttt180 -58.24 -47.24 84.15 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.484 0.714 . . . . 0.0 110.671 174.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -54.08 -45.47 72.45 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.299 0.952 . . . . 0.0 112.793 176.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.08 -37.19 83.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.01 0.905 . . . . 0.0 113.16 174.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.42 -50.01 61.26 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 120.627 1.558 . . . . 0.0 112.324 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.0 pp -65.45 -34.82 79.19 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.732 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.35 -48.38 75.75 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-O 119.054 -0.498 . . . . 0.0 111.301 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.0 mp -61.01 -28.07 68.77 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.349 -1.31 . . . . 0.0 111.471 175.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.39 -58.47 6.97 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 120.154 1.343 . . . . 0.0 111.851 172.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -66.75 -37.14 84.05 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.276 -0.89 . . . . 0.0 112.48 178.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.21 -45.02 90.1 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.154 1.382 . . . . 0.0 112.102 174.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -59.3 -42.26 90.93 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 118.876 -0.583 . . . . 0.0 110.609 171.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.99 -33.61 59.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-O 118.091 -0.957 . . . . 0.0 112.17 175.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -62.87 -44.04 97.18 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.398 0.999 . . . . 0.0 112.466 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -100.21 14.2 31.65 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 174.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 23.2 ttpt -66.09 -40.4 90.79 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 120.639 -1.288 . . . . 0.0 112.865 -175.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -72.73 -177.0 2.16 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.072 0.949 . . . . 0.0 108.882 171.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 58.19 28.8 17.04 Favored 'General case' 0 CA--C 1.552 1.045 0 O-C-N 120.604 -1.31 . . . . 0.0 114.298 175.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 9.6 mt . . . . . 0 CA--C 1.55 0.957 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 174.442 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 63.4 m170 . . . . . 0 CA--C 1.555 1.155 0 N-CA-C 115.422 1.638 . . . . 0.0 115.422 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 11.2 mp 69.1 152.48 0.13 Allowed Pre-proline 0 CA--C 1.553 1.077 0 C-N-CA 129.269 3.028 . . . . 0.0 114.437 -168.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -79.9 -22.62 7.37 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.286 2.657 . . . . 0.0 115.126 -170.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.5 p -121.68 155.96 34.06 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.139 1.375 . . . . 0.0 111.097 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.0 t -104.19 127.86 51.85 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.552 -0.718 . . . . 0.0 112.147 -176.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 43.2 p90 -85.92 20.58 2.18 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.635 1.974 . . . . 0.0 113.335 -177.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 44.6 ttp180 61.34 -27.38 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 128.861 2.864 . . . . 0.0 116.596 -177.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -73.67 72.71 1.24 Allowed Glycine 0 CA--C 1.531 1.05 0 C-N-CA 125.613 1.578 . . . . 0.0 114.261 -178.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.5 t -56.56 -23.71 42.13 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -176.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.9 t -157.35 163.51 38.55 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.238 1.415 . . . . 0.0 110.961 165.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 10.0 p -90.24 159.04 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 125.58 1.552 . . . . 0.0 111.934 178.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -134.59 29.23 3.57 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.698 -0.627 . . . . 0.0 112.128 -169.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -77.06 129.55 9.77 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 124.892 1.234 . . . . 0.0 114.389 179.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.0 t -126.54 24.44 6.67 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.643 1.977 . . . . 0.0 112.236 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -62.07 154.31 27.29 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.824 1.25 . . . . 0.0 114.262 -168.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 35.8 p -92.24 152.92 19.59 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.067 1.347 . . . . 0.0 112.956 177.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.3 t -122.89 137.27 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 126.052 1.741 . . . . 0.0 107.926 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.4 ' HB3' HD21 ' A' ' 86' ' ' ASN . 15.5 t0 -75.8 175.64 8.53 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.428 1.091 . . . . 0.0 111.794 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.7 -12.38 1.83 Allowed 'General case' 0 CA--C 1.553 1.09 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 -174.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.8 m -155.63 64.53 0.6 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.773 1.629 . . . . 0.0 110.536 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 73.6 -123.96 8.48 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 121.709 -0.619 . . . . 0.0 111.97 -174.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.4 HD21 ' HB3' ' A' ' 82' ' ' ASP . 6.7 m-80 55.31 -179.51 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.864 1.265 . . . . 0.0 112.733 -172.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -115.3 127.23 55.31 Favored 'General case' 0 N--CA 1.481 1.116 0 O-C-N 120.291 -1.506 . . . . 0.0 110.747 171.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.8 mt -96.23 154.66 17.13 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 122.709 1.243 . . . . 0.0 112.863 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 32.6 mm -78.48 93.57 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 124.555 1.142 . . . . 0.0 111.235 -175.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . 0.255 13.7 t -132.15 12.96 4.69 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 66.82 -19.27 0.11 Allowed 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 116.671 2.1 . . . . 0.0 116.671 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -42.62 -51.22 5.27 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 126.385 1.874 . . . . 0.0 114.828 178.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 21.6 pt -55.51 -31.29 27.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.7 mtp85 -67.02 -43.77 81.98 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.164 -0.96 . . . . 0.0 111.527 175.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -69.51 -19.67 63.72 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.699 1.6 . . . . 0.0 112.919 176.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.86 -56.94 4.15 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.087 1.355 . . . . 0.0 111.246 167.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -59.82 -41.5 91.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.095 0.861 . . . . 0.0 112.89 -178.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -64.96 -37.68 88.46 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.875 0.761 . . . . 0.0 111.953 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.08 -30.44 70.35 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.415 0.895 . . . . 0.0 113.415 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -89.12 -38.23 14.48 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.793 0.837 . . . . 0.0 113.043 173.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.2 mt -59.02 -45.25 91.16 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.342 0.974 . . . . 0.0 111.041 176.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.3 m -74.35 5.64 4.39 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.105 1.362 . . . . 0.0 114.307 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -121.73 4.52 10.04 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.753 1.621 . . . . 0.0 115.005 -177.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 10.4 p -68.58 -36.72 75.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 114.873 1.435 . . . . 0.0 114.873 -170.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 52.29 -147.6 12.98 Favored Glycine 0 CA--C 1.544 1.882 0 N-CA-C 115.711 1.044 . . . . 0.0 115.711 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -96.39 8.98 42.66 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 122.43 -0.453 . . . . 0.0 110.807 175.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -70.61 153.98 94.64 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 123.562 0.745 . . . . 0.0 111.818 174.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.49 120.91 7.83 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.63 2.22 . . . . 0.0 111.172 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.0 mt -49.38 -32.08 10.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.901 1.28 . . . . 0.0 112.922 177.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -53.5 -37.45 62.76 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.79 1.636 . . . . 0.0 112.831 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -89.9 -37.15 14.61 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 -179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 47.7 t -55.56 -50.23 70.59 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.345 0.658 . . . . 0.0 110.992 172.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.2 pp -67.51 -34.1 76.42 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.465 -0.778 . . . . 0.0 112.962 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.0 -42.9 99.97 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.973 0.806 . . . . 0.0 111.697 -174.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 70.1 mtt-85 -70.03 -44.94 68.22 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.665 -0.647 . . . . 0.0 111.81 171.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.2 tt -50.08 -61.55 2.09 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.231 1.013 . . . . 0.0 111.533 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.97 -27.51 68.33 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.514 -1.366 . . . . 0.0 113.387 179.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.69 -43.5 68.9 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 124.127 0.892 . . . . 0.0 111.566 177.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -53.98 -52.39 60.87 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.641 0.776 . . . . 0.0 111.545 176.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.18 -42.71 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 O-C-N 121.371 -0.831 . . . . 0.0 111.922 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.28 -31.03 68.21 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.029 -1.045 . . . . 0.0 113.596 -178.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.08 -63.97 0.95 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.417 0.687 . . . . 0.0 110.483 169.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -62.06 -50.44 71.96 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.19 2.196 . . . . 0.0 113.929 -171.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -78.59 164.47 24.64 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 122.276 1.036 . . . . 0.0 110.328 176.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -77.2 -94.13 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.183 0.993 . . . . 0.0 111.447 -169.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.424 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 37.6 tt0 -140.79 -58.68 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 124.646 1.178 . . . . 0.0 110.454 167.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . 0.424 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.2 Cg_endo -66.88 -35.75 25.68 Favored 'Trans proline' 0 C--N 1.352 0.739 0 CA-C-N 122.036 1.763 . . . . 0.0 111.484 176.047 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.98 -32.01 67.46 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 120.98 -1.075 . . . . 0.0 112.779 173.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.14 -48.77 74.73 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.063 1.345 . . . . 0.0 109.903 173.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.19 -34.32 87.63 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 126.415 1.959 . . . . 0.0 114.49 176.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -74.98 -30.71 61.26 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.777 1.288 . . . . 0.0 110.475 173.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.86 58.42 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 122.909 0.484 . . . . 0.0 110.357 -176.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -66.51 -39.76 88.85 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 118.914 -0.565 . . . . 0.0 111.841 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.42 -54.54 44.3 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.37 0.986 . . . . 0.0 111.913 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 9.2 mp -64.45 -25.96 68.23 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.698 176.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 59.7 ttp -65.78 -53.02 45.96 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 120.056 1.298 . . . . 0.0 111.831 172.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . 0.407 ' HA ' HE21 ' A' ' 137' ' ' GLN . 0.0 OUTLIER -66.92 -43.15 84.03 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.122 0.874 . . . . 0.0 111.619 178.344 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -28.16 68.29 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.412 1.085 . . . . 0.0 112.846 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -68.0 -47.74 67.68 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.468 -1.395 . . . . 0.0 111.186 167.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 85.8 mt -62.27 -38.58 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.387 1.075 . . . . 0.0 112.561 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -52.98 -32.92 48.85 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.215 1.806 . . . . 0.0 113.09 173.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -112.85 2.69 16.02 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.405 1.482 . . . . 0.0 114.02 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -72.39 -19.16 61.65 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.932 1.693 . . . . 0.0 112.681 175.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -88.92 136.96 32.73 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.477 1.111 . . . . 0.0 110.109 174.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -77.51 42.76 0.37 Allowed 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 124.944 1.298 . . . . 0.0 113.687 177.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 48.0 mt . . . . . 0 CA--C 1.547 0.843 0 C-N-CA 131.18 3.792 . . . . 0.0 117.018 -178.747 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 50.6 m170 . . . . . 0 CA--C 1.553 1.058 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 41.8 tp -128.09 73.67 79.37 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 126.373 1.869 . . . . 0.0 110.435 179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -63.72 140.3 73.58 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.087 1.858 . . . . 0.0 110.453 171.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 75.1 p -104.57 152.62 22.2 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.739 0.816 . . . . 0.0 112.765 -170.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.4 t -159.04 128.88 5.66 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 123.793 0.837 . . . . 0.0 110.693 176.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 41.2 p90 -163.51 154.66 16.58 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.642 1.577 . . . . 0.0 111.372 178.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.3 mtt85 -172.5 143.18 1.34 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 126.428 1.891 . . . . 0.0 109.771 172.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -169.99 51.34 0.2 Allowed Glycine 0 CA--C 1.529 0.965 0 CA-C-O 119.33 -0.706 . . . . 0.0 114.566 -175.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . 0.257 21.0 p 55.21 -3.67 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 128.34 2.656 . . . . 0.0 117.841 177.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 62.1 m -120.63 -167.25 1.44 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 128.019 2.528 . . . . 0.0 111.041 173.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.4 p -142.68 144.89 23.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.883 1.273 . . . . 0.0 111.786 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -84.6 91.09 7.81 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 123.049 1.404 . . . . 0.0 108.884 171.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -54.78 -157.14 0.01 OUTLIER Glycine 0 CA--C 1.549 2.171 0 N-CA-C 116.719 1.447 . . . . 0.0 116.719 169.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.8 t -129.89 116.48 18.72 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.534 1.534 . . . . 0.0 110.0 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -78.1 178.98 7.12 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 128.041 2.536 . . . . 0.0 113.157 -174.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 32.5 p -115.35 161.67 18.19 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.771 1.229 . . . . 0.0 113.921 176.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.1 t -135.7 133.42 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 126.174 1.79 . . . . 0.0 109.541 -171.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -88.98 178.25 6.45 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.722 1.209 . . . . 0.0 112.961 177.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.53 -1.64 0.16 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 127.928 2.491 . . . . 0.0 117.718 -167.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 31.0 t -152.56 35.94 0.51 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.398 1.479 . . . . 0.0 111.372 173.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 87.47 -123.15 6.48 Favored Glycine 0 CA--C 1.529 0.912 0 O-C-N 120.934 -1.104 . . . . 0.0 110.649 -167.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 59.39 175.92 0.08 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.951 0.9 . . . . 0.0 111.665 -163.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.9 132.48 52.8 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 117.788 -1.101 . . . . 0.0 108.901 165.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.3 mt -98.69 150.51 21.72 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.916 1.235 . . . . 0.0 112.316 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 24.5 mt -63.62 111.81 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 125.144 1.378 . . . . 0.0 110.628 -173.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -142.74 154.38 44.22 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.76 1.224 . . . . 0.0 112.291 -173.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -101.03 -10.54 20.43 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -164.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -64.69 -29.48 70.47 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.892 0.877 . . . . 0.0 111.66 168.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 64.5 mt -49.77 -40.38 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 125.778 1.631 . . . . 0.0 112.103 175.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.18 -53.19 58.84 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 121.417 -0.802 . . . . 0.0 110.978 173.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -61.45 -30.0 70.31 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.823 0.849 . . . . 0.0 111.997 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.88 -53.52 52.84 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.984 1.714 . . . . 0.0 111.746 173.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -60.94 -43.55 98.51 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.32 -0.848 . . . . 0.0 112.416 173.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.47 -40.65 87.64 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.179 1.354 . . . . 0.0 112.636 177.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.88 -20.78 66.61 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -112.39 -21.74 11.22 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.365 1.066 . . . . 0.0 113.656 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.12 -48.94 74.12 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 118.998 0.817 . . . . 0.0 110.079 169.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 11.3 m -68.73 -18.57 64.25 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.809 0.843 . . . . 0.0 113.137 179.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -81.86 -7.53 59.61 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -176.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 8.9 p -69.56 -40.82 80.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -169.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 53.82 -128.82 40.81 Favored Glycine 0 CA--C 1.538 1.509 0 O-C-N 121.602 -0.686 . . . . 0.0 112.75 -171.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -87.87 -12.23 45.46 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.748 1.219 . . . . 0.0 113.573 176.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -75.65 147.56 81.68 Favored Pre-proline 0 CA--C 1.546 0.789 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -164.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -63.97 139.01 65.5 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 122.351 2.034 . . . . 0.0 111.432 177.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 18.1 mt -52.09 -26.91 12.24 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 -173.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -46.24 -43.22 15.3 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.93 1.292 . . . . 0.0 113.477 176.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -80.69 -39.6 26.87 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 120.318 1.417 . . . . 0.0 113.329 -176.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 38.6 t -64.94 -44.12 90.48 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.546 -0.721 . . . . 0.0 110.941 176.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.1 pp -68.45 -29.27 67.88 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 118.127 -0.939 . . . . 0.0 112.576 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -62.21 -58.43 7.77 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.041 0.837 . . . . 0.0 110.809 174.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.4 mtt85 -59.97 -40.61 89.69 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.071 -1.018 . . . . 0.0 112.263 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 50.5 tp -62.12 -57.35 11.88 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.795 0.838 . . . . 0.0 112.496 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.6 ptm85 -60.91 -33.8 73.7 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.677 -0.639 . . . . 0.0 111.589 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.66 -44.02 87.58 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 124.198 0.936 . . . . 0.0 111.421 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.74 -42.7 81.42 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.477 0.711 . . . . 0.0 110.741 176.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 18.0 mt -61.09 -42.44 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.259 -0.901 . . . . 0.0 111.208 176.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.38 -22.2 61.91 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -84.64 -31.62 24.1 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 171.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -99.73 -34.77 10.04 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 115.324 1.601 . . . . 0.0 115.324 -173.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 60.2 mt -81.72 174.32 11.47 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.394 0.997 . . . . 0.0 111.611 167.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.34 -97.56 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.93 0.892 . . . . 0.0 111.525 -176.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 49.3 tt0 -145.43 -57.54 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.629 0 O-C-N 120.964 -1.085 . . . . 0.0 110.293 179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.76 -37.94 8.49 Favored 'Trans proline' 0 C--N 1.355 0.897 0 CA-C-N 121.581 1.6 . . . . 0.0 112.133 173.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.73 -39.85 68.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.699 1.2 . . . . 0.0 112.157 176.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -58.17 -46.81 85.09 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.128 1.371 . . . . 0.0 110.74 174.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -56.3 -34.37 62.97 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 125.363 1.459 . . . . 0.0 113.621 175.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -77.61 -30.6 52.46 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 118.622 1.211 . . . . 0.0 111.494 175.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.36 -45.4 60.03 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.541 -0.725 . . . . 0.0 111.291 -178.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.79 -34.11 75.0 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.611 -0.709 . . . . 0.0 112.371 173.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.87 -53.58 56.18 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 119.144 0.884 . . . . 0.0 111.614 173.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 72.6 mt -55.41 -37.16 67.26 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.05 0.54 . . . . 0.0 111.328 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -52.51 46.56 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.051 0.94 . . . . 0.0 111.933 177.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -64.68 -38.94 92.71 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.735 -1.228 . . . . 0.0 112.834 178.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -43.76 98.19 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.837 1.255 . . . . 0.0 111.165 172.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -60.51 -39.87 89.32 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.533 -0.73 . . . . 0.0 111.566 172.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 59.7 mt -67.13 -35.21 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 119.934 1.243 . . . . 0.0 112.359 177.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -58.02 -49.78 75.68 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.492 0.717 . . . . 0.0 110.32 170.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -93.08 -0.53 57.05 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -173.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -65.35 -36.43 84.0 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.437 1.095 . . . . 0.0 112.646 -178.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 5.7 ptpp? -100.31 177.26 5.1 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.957 0.903 . . . . 0.0 110.902 169.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 57.64 33.17 22.91 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 6.2 mp . . . . . 0 CA--C 1.548 0.892 0 C-N-CA 127.002 2.121 . . . . 0.0 114.683 170.09 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 80.1 m80 . . . . . 0 CA--C 1.539 0.536 0 CA-C-O 120.914 0.388 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.7 mp -122.24 159.7 50.99 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 127.702 2.401 . . . . 0.0 109.049 174.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -73.97 60.75 4.63 Favored 'Trans proline' 0 CA--C 1.549 1.243 0 C-N-CA 124.574 3.516 . . . . 0.0 113.08 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 76.2 p -103.19 116.45 32.49 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.849 -1.157 . . . . 0.0 113.269 -169.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.0 p -92.54 -175.04 3.86 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.952 1.701 . . . . 0.0 111.461 161.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 46.3 49.07 13.15 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 126.521 1.929 . . . . 0.0 114.015 178.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.16 137.49 53.37 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 120.857 -1.152 . . . . 0.0 112.341 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -154.12 135.55 4.81 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 126.632 2.063 . . . . 0.0 108.151 168.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.9 t -132.48 12.53 4.52 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.041 0.936 . . . . 0.0 112.122 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -77.75 40.08 0.3 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 128.051 2.54 . . . . 0.0 112.797 -173.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.9 m -137.9 143.67 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.032 1.333 . . . . 0.0 111.582 -164.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -160.45 110.26 1.76 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.979 1.312 . . . . 0.0 108.862 176.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -77.37 129.34 9.54 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-O 118.967 -0.907 . . . . 0.0 111.022 166.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.7 t -102.32 46.88 0.91 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.475 1.91 . . . . 0.0 109.951 168.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -63.24 163.92 9.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.504 1.122 . . . . 0.0 111.689 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.6 p -112.35 149.64 32.18 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.368 1.067 . . . . 0.0 113.072 -173.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.1 t -122.5 129.87 74.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.988 1.715 . . . . 0.0 109.67 -173.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.454 ' HB3' HD21 ' A' ' 86' ' ' ASN . 3.0 t0 -80.74 179.81 7.62 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.997 1.719 . . . . 0.0 112.537 178.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.29 -3.41 0.62 Allowed 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 116.603 2.075 . . . . 0.0 116.603 -172.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.7 m -162.6 64.59 0.21 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.671 1.988 . . . . 0.0 109.864 168.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.72 -123.91 6.4 Favored Glycine 0 CA--C 1.53 1.022 0 O-C-N 121.478 -0.764 . . . . 0.0 111.601 -177.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.454 HD21 ' HB3' ' A' ' 82' ' ' ASP . 7.1 m-80 57.25 179.42 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.848 1.259 . . . . 0.0 112.972 -171.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.79 118.6 36.59 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.242 -0.911 . . . . 0.0 109.376 169.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.8 mt -84.77 160.87 20.18 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 122.145 0.974 . . . . 0.0 111.611 171.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 15.9 mt -80.33 91.64 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 124.448 1.099 . . . . 0.0 110.4 -173.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 53.4 p -133.24 153.79 51.24 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.699 1.199 . . . . 0.0 110.708 164.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 8.9 tpp85 -70.49 -7.92 47.26 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -162.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -55.36 -44.93 76.45 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 127.108 2.163 . . . . 0.0 115.061 -167.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 39.5 pt -60.4 -28.47 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 123.826 0.851 . . . . 0.0 112.828 -173.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 62.5 ttt-85 -68.55 -35.89 78.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 122.672 0.389 . . . . 0.0 110.95 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -79.24 -34.24 42.88 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.283 0.633 . . . . 0.0 111.804 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.8 mp -56.96 -51.59 68.61 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.889 -0.577 . . . . 0.0 111.509 165.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -61.26 -42.96 99.53 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.956 0.798 . . . . 0.0 111.697 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.02 -41.88 97.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.33 0.968 . . . . 0.0 112.668 -179.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.92 -44.9 96.56 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.276 -0.89 . . . . 0.0 111.824 178.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -83.68 -8.96 59.17 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.2 mt -78.91 -33.19 45.76 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.812 1.187 . . . . 0.0 112.473 169.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 12.5 t -77.07 -38.07 53.26 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.259 0.936 . . . . 0.0 112.274 171.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -89.35 24.13 2.31 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.593 1.157 . . . . 0.0 113.882 171.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 8.4 p -61.67 -25.1 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 O-C-N 121.034 -1.041 . . . . 0.0 113.632 -171.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 110.48 153.34 13.59 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 125.064 1.316 . . . . 0.0 112.341 -176.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -109.5 -12.71 14.67 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.428 1.091 . . . . 0.0 111.28 174.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -150.9 -55.52 0.02 OUTLIER Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 128.509 2.724 . . . . 0.0 112.713 173.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -75.14 52.05 3.0 Favored 'Trans proline' 0 CA--C 1.55 1.302 0 C-N-CA 124.542 3.495 . . . . 0.0 115.139 -173.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.65 -40.75 69.31 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.467 1.907 . . . . 0.0 112.187 -178.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -63.15 -22.94 67.2 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -93.76 -37.1 11.96 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.004 0.82 . . . . 0.0 113.094 -176.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 75.9 p -63.38 -42.39 98.84 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 122.937 0.495 . . . . 0.0 110.482 173.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.35 -35.81 81.31 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 118.321 -0.847 . . . . 0.0 112.416 177.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -66.52 -41.26 89.05 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 119.47 1.032 . . . . 0.0 112.108 -174.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -69.3 -41.8 76.27 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 120.924 -1.11 . . . . 0.0 112.466 170.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 46.2 tp -51.47 -63.38 1.15 Allowed 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.044 0.537 . . . . 0.0 111.701 175.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -30.66 68.1 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.273 1.029 . . . . 0.0 112.75 177.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.54 -39.9 94.62 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 174.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -62.65 -51.38 67.5 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.062 0.846 . . . . 0.0 111.9 174.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.4 mp -58.75 -41.53 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.319 0.963 . . . . 0.0 111.118 177.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.1 -18.13 63.94 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -101.32 -33.2 10.13 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -78.52 -45.46 21.87 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.382 1.073 . . . . 0.0 112.45 177.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -84.89 174.88 9.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.12 0.968 . . . . 0.0 111.574 176.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.85 -99.99 0.1 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.282 0.633 . . . . 0.0 112.288 -177.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -135.22 -63.9 0.02 OUTLIER Pre-proline 0 N--CA 1.472 0.657 0 O-C-N 120.807 -1.183 . . . . 0.0 109.138 -179.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -68.58 -34.03 20.66 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 CA-C-N 121.127 1.438 . . . . 0.0 111.702 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.75 -36.39 78.8 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 120.77 -1.206 . . . . 0.0 112.078 174.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -63.91 -49.51 72.37 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.509 1.124 . . . . 0.0 110.413 172.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.32 -34.13 73.29 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.871 1.224 . . . . 0.0 113.879 178.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -75.08 -33.67 61.69 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.466 1.133 . . . . 0.0 110.682 175.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.47 -46.13 64.36 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.698 -0.626 . . . . 0.0 110.926 -176.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.29 -36.63 79.65 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 118.804 -0.617 . . . . 0.0 112.176 174.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.7 -54.08 49.63 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.301 0.955 . . . . 0.0 111.976 175.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 97.0 mt -58.7 -34.73 71.64 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.395 176.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 49.5 ttp -65.38 -52.02 56.45 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.4 0.68 . . . . 0.0 112.26 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -64.33 -42.9 96.06 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.768 -0.582 . . . . 0.0 111.604 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -44.9 95.99 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.604 1.162 . . . . 0.0 111.715 176.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -59.9 -44.48 94.22 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.155 0.434 . . . . 0.0 111.467 174.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 74.6 mt -62.24 -35.32 68.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 118.686 0.675 . . . . 0.0 111.414 176.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -63.02 -32.19 73.5 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.029 0.932 . . . . 0.0 113.111 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 3.5 p90 -108.81 -0.14 20.05 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 116.242 1.941 . . . . 0.0 116.242 174.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -55.47 -43.81 75.86 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.752 1.621 . . . . 0.0 112.634 178.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 42.7 mtpt -111.51 142.13 44.18 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.443 1.497 . . . . 0.0 110.759 -176.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -76.83 56.46 1.18 Allowed 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.048 1.339 . . . . 0.0 112.787 -177.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 83.9 mt . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 129.669 3.188 . . . . 0.0 118.087 176.096 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 48.6 m170 . . . . . 0 CA--C 1.54 0.572 0 CA-C-O 120.544 0.212 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.8 mp -128.39 151.5 76.66 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 125.269 1.428 . . . . 0.0 110.926 -177.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -67.32 170.29 13.71 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.211 3.274 . . . . 0.0 113.58 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.9 t -58.81 131.2 50.25 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 122.608 1.194 . . . . 0.0 112.306 -174.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.2 p -178.06 167.23 2.02 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 128.304 2.642 . . . . 0.0 107.274 -167.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -46.99 106.02 0.08 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.978 0.911 . . . . 0.0 112.922 -174.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.59 123.79 33.42 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.621 1.168 . . . . 0.0 111.88 -173.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -177.87 141.98 5.41 Favored Glycine 0 CA--C 1.526 0.77 0 C-N-CA 125.678 1.609 . . . . 0.0 110.34 168.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.44 44.68 1.97 Allowed 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 122.871 1.32 . . . . 0.0 110.282 -174.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.5 t -138.92 148.86 44.14 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 127.667 2.387 . . . . 0.0 109.263 173.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 13.3 p -57.92 169.01 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.07 0 C-N-CA 127.132 2.173 . . . . 0.0 112.568 172.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -131.8 -18.65 2.7 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.591 1.556 . . . . 0.0 115.141 -179.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -140.41 144.31 14.69 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.552 1.072 . . . . 0.0 111.623 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.8 t -78.33 74.03 4.87 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.636 1.174 . . . . 0.0 111.397 -179.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -65.78 152.79 43.54 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.801 0.81 . . . . 0.0 111.602 177.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 98.5 p -133.56 157.8 44.77 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.867 0.841 . . . . 0.0 113.002 -173.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.6 t -127.71 130.93 70.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.338 1.455 . . . . 0.0 110.088 -166.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -79.12 173.32 12.7 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.346 1.858 . . . . 0.0 113.632 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.54 -10.12 2.03 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 -177.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 19.8 m -138.29 29.88 2.44 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.793 1.637 . . . . 0.0 111.848 175.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 93.13 -109.08 3.74 Favored Glycine 0 C--N 1.339 0.746 0 O-C-N 120.445 -1.409 . . . . 0.0 110.766 -173.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 52.05 -172.16 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.679 1.191 . . . . 0.0 113.758 -174.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -113.48 126.03 54.87 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 164.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.5 mt -91.61 140.96 29.23 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.338 0.972 . . . . 0.0 110.27 170.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 31.6 mm -80.68 105.46 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.917 0.865 . . . . 0.0 110.851 -178.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.1 p -132.56 22.63 4.33 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 125.255 1.422 . . . . 0.0 113.247 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 64.24 -4.39 0.41 Allowed 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 126.811 2.045 . . . . 0.0 115.88 177.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -54.78 -53.83 50.08 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 129.23 3.012 . . . . 0.0 114.834 178.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 30.2 pt -54.77 -33.3 27.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.928 0.891 . . . . 0.0 113.177 -177.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -65.01 -38.58 91.41 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.984 1.265 . . . . 0.0 112.217 177.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -67.97 -35.11 77.81 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.238 0.615 . . . . 0.0 111.553 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.18 -44.02 80.72 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.807 0.843 . . . . 0.0 111.35 174.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -63.6 -43.6 96.44 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.099 0.863 . . . . 0.0 112.693 171.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -58.09 -46.43 85.51 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.599 1.09 . . . . 0.0 112.75 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.62 -30.97 67.66 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -102.19 -12.17 18.23 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 24.7 mt -74.86 -41.1 60.46 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.617 1.098 . . . . 0.0 111.376 167.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 5.7 t -67.05 -47.37 71.54 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.322 0.51 . . . . 0.0 110.852 175.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -87.61 23.55 1.92 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.76 1.624 . . . . 0.0 114.996 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 7.2 p -61.33 -25.57 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 N-CA-C 114.22 1.192 . . . . 0.0 114.22 -171.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.06 178.65 49.92 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.549 1.071 . . . . 0.0 113.699 -177.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -134.78 -61.44 0.76 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.373 1.069 . . . . 0.0 109.727 -175.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -77.79 -54.16 1.39 Allowed Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 124.572 1.149 . . . . 0.0 113.771 168.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -77.89 33.34 0.45 Allowed 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 124.292 3.328 . . . . 0.0 114.267 -175.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.28 -35.89 63.05 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.503 1.921 . . . . 0.0 113.126 -171.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.83 -40.76 92.07 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.364 -0.835 . . . . 0.0 112.698 177.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -83.77 -28.56 28.08 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 121.013 -1.054 . . . . 0.0 112.971 -172.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 68.6 p -65.13 -44.92 87.11 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 118.56 0.618 . . . . 0.0 111.181 175.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.8 -27.89 66.28 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 122.555 0.342 . . . . 0.0 111.617 175.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -72.22 -46.75 54.79 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 111.417 0.154 . . . . 0.0 111.417 -174.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -66.23 -35.47 80.51 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 118.451 -0.785 . . . . 0.0 111.821 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 55.3 tp -57.94 -61.81 2.27 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.623 0.769 . . . . 0.0 111.025 176.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -60.58 -27.79 67.97 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.278 -0.889 . . . . 0.0 112.726 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.07 -37.53 66.76 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.86 0.864 . . . . 0.0 113.044 173.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -63.68 -53.38 52.22 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.096 -0.954 . . . . 0.0 111.499 174.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.7 mp -55.79 -36.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 120.633 1.56 . . . . 0.0 111.537 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.522 ' HA ' ' HD2' ' A' ' 129' ' ' ARG . . . -70.68 -24.78 62.74 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.537 1.68 . . . . 0.0 115.537 178.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -99.22 -29.31 12.9 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.997 1.319 . . . . 0.0 113.785 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -82.26 -46.14 14.08 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.484 1.514 . . . . 0.0 113.694 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 7.5 mp -89.21 176.3 7.01 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.02 0.928 . . . . 0.0 110.495 171.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.38 -96.94 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.941 0.896 . . . . 0.0 111.767 -175.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.416 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 34.7 tt0 -155.03 -52.65 0.02 OUTLIER Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 124.96 1.304 . . . . 0.0 110.909 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . 0.416 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 56.7 Cg_endo -64.78 -43.9 11.59 Favored 'Trans proline' 0 C--N 1.353 0.804 0 CA-C-N 121.673 1.633 . . . . 0.0 109.948 167.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -49.97 -38.83 38.68 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.851 1.261 . . . . 0.0 113.007 172.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.522 ' HD2' ' HA ' ' A' ' 121' ' ' ALA . 26.5 ttt180 -72.19 -42.53 65.73 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 121.602 -0.686 . . . . 0.0 110.869 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.8 -32.62 75.08 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-O 119.524 -0.598 . . . . 0.0 113.976 175.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -79.28 -30.35 42.93 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.34 1.07 . . . . 0.0 111.29 175.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.36 -46.91 63.16 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.646 -0.659 . . . . 0.0 111.109 -178.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.7 pp -66.79 -36.63 82.85 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.308 0.643 . . . . 0.0 112.393 175.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.99 -52.0 64.67 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.659 -0.65 . . . . 0.0 112.426 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.86 -28.82 69.76 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.489 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 9.4 tmm? -67.36 -53.47 29.19 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.044 0.838 . . . . 0.0 112.105 175.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.59 -42.32 98.69 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.07 -1.019 . . . . 0.0 113.363 172.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.37 -42.29 96.25 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.167 0.987 . . . . 0.0 111.959 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 32.7 t80 -59.56 -43.83 93.46 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.751 -0.593 . . . . 0.0 111.242 171.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.11 -41.74 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-O 118.667 -0.683 . . . . 0.0 112.132 -178.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -61.16 -49.91 75.31 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.091 0.956 . . . . 0.0 111.523 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.9 m-30 -89.01 6.62 38.84 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -175.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -64.8 -32.74 74.58 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.194 1.397 . . . . 0.0 112.188 174.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -85.47 134.38 34.06 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.4 1.88 . . . . 0.0 110.683 176.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -89.53 43.36 1.14 Allowed 'General case' 0 N--CA 1.479 0.991 0 O-C-N 121.1 -1.0 . . . . 0.0 113.056 170.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 7.1 mp . . . . . 0 CA--C 1.556 1.179 0 N-CA-C 116.714 2.116 . . . . 0.0 116.714 173.508 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 12.5 t-160 . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 70.2 mt 49.71 70.9 1.77 Allowed Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 125.196 1.398 . . . . 0.0 113.624 -178.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -59.5 131.04 38.31 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 122.013 1.808 . . . . 0.0 110.556 170.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.8 t -147.39 -12.75 0.4 Allowed 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -167.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.5 t -79.21 129.68 34.71 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.316 0.962 . . . . 0.0 111.877 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -80.21 144.07 33.24 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.209 1.004 . . . . 0.0 112.788 -178.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.22 -26.85 68.02 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -176.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -116.6 -167.27 14.62 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.383 1.468 . . . . 0.0 112.405 176.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.3 p -92.94 92.17 7.74 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.273 -1.134 . . . . 0.0 111.943 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.2 t -159.36 143.95 15.37 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.349 1.06 . . . . 0.0 111.663 168.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 15.7 m -157.22 165.77 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 127.504 2.322 . . . . 0.0 110.679 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.86 -38.0 77.77 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.997 2.119 . . . . 0.0 115.912 -174.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.63 -141.08 25.12 Favored Glycine 0 CA--C 1.547 2.062 0 C-N-CA 125.503 1.525 . . . . 0.0 114.834 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.4 t -148.7 155.3 40.83 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.868 2.067 . . . . 0.0 109.886 -175.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.834 ' HA ' ' OD1' ' A' ' 92' ' ' ASP . 6.6 p90 -147.54 172.96 13.17 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -164.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 94.0 p -88.29 168.03 13.05 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.821 2.049 . . . . 0.0 114.883 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 p -154.22 136.89 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 125.541 1.537 . . . . 0.0 111.484 -177.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -84.35 170.95 13.1 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.632 1.173 . . . . 0.0 111.579 173.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.96 3.76 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 117.688 2.477 . . . . 0.0 117.688 -170.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 39.5 m -159.22 52.09 0.38 Allowed 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.008 1.723 . . . . 0.0 110.109 168.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.89 -124.35 6.43 Favored Glycine 0 CA--C 1.528 0.899 0 O-C-N 120.2 -1.562 . . . . 0.0 111.228 -174.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 59.79 177.8 0.09 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.333 1.053 . . . . 0.0 111.615 -169.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.1 mt -112.14 128.23 56.16 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.824 -1.172 . . . . 0.0 109.536 170.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mt -95.52 161.83 13.9 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.992 0.901 . . . . 0.0 111.807 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.4 mm -83.87 89.64 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 124.599 1.16 . . . . 0.0 111.494 -173.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 69.3 p -141.62 166.43 24.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.709 175.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.401 ' CG ' ' HD3' ' A' ' 94' ' ' ARG . 43.7 ttm-85 -93.02 45.41 1.18 Allowed 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 115.005 -0.998 . . . . 0.0 113.398 -164.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.834 ' OD1' ' HA ' ' A' ' 79' ' ' PHE . 0.2 OUTLIER -102.71 -60.16 1.59 Allowed 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.614 -0.679 . . . . 0.0 112.691 -178.358 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 20.8 pt -47.41 -24.04 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -176.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.401 ' HD3' ' CG ' ' A' ' 91' ' ' ARG . 9.5 ptm85 -74.06 -31.03 62.69 Favored 'General case' 0 N--CA 1.456 -0.127 0 O-C-N 120.896 -1.127 . . . . 0.0 111.249 -177.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -74.4 -32.03 62.55 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.317 1.047 . . . . 0.0 111.032 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.3 tt -63.44 -52.75 60.14 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.577 1.551 . . . . 0.0 110.661 176.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -56.58 -46.01 81.02 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.295 -0.878 . . . . 0.0 112.731 169.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.57 -38.87 85.98 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 119.661 1.119 . . . . 0.0 112.55 -179.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.82 -37.17 83.45 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.189 0.996 . . . . 0.0 112.982 178.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -99.85 -3.66 32.07 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 34.7 mt -82.85 -24.06 33.42 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.194 -0.942 . . . . 0.0 112.892 166.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 70.2 m -85.09 138.76 32.21 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 170.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 59.23 18.21 6.38 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 116.307 1.965 . . . . 0.0 116.307 166.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 11.7 p -53.44 -28.45 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 -167.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 170.75 151.11 7.35 Favored Glycine 0 CA--C 1.526 0.758 0 C-N-CA 125.327 1.442 . . . . 0.0 110.357 175.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -82.88 -39.22 21.85 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 117.273 0.536 . . . . 0.0 112.131 -179.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -156.19 -56.06 0.02 OUTLIER Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 125.994 1.718 . . . . 0.0 113.272 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -71.34 69.43 2.58 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 124.589 3.526 . . . . 0.0 113.293 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.21 75.81 1.3 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.019 1.327 . . . . 0.0 111.485 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -128.74 -76.11 0.56 Allowed 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.888 1.275 . . . . 0.0 110.868 169.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.72 -29.98 70.46 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -167.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.1 m -57.85 -46.03 85.38 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.234 0.924 . . . . 0.0 112.154 174.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.73 -36.75 76.14 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 122.396 0.278 . . . . 0.0 110.438 178.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -65.33 -37.12 86.13 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 122.698 0.399 . . . . 0.0 111.48 -176.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -72.14 -45.01 62.23 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 117.568 -1.206 . . . . 0.0 111.767 172.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 42.6 tp -49.47 -63.36 1.13 Allowed 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 118.995 0.816 . . . . 0.0 111.791 176.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -60.8 -30.91 70.34 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.911 -1.118 . . . . 0.0 112.709 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.38 -38.03 84.1 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 175.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -60.33 -51.2 70.51 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 119.15 0.886 . . . . 0.0 111.131 173.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.5 mp -58.59 -42.26 84.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-N 119.107 0.867 . . . . 0.0 111.318 175.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.02 -20.97 63.24 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 115.344 1.609 . . . . 0.0 115.344 -178.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -98.05 -37.39 9.77 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.881 1.272 . . . . 0.0 113.218 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -73.12 -52.43 14.26 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.724 0.81 . . . . 0.0 112.979 173.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -83.83 159.18 21.44 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 122.4 1.095 . . . . 0.0 109.983 175.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -77.67 -84.41 0.07 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.423 -169.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -153.72 -61.6 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 117.961 -1.018 . . . . 0.0 110.405 -178.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -66.65 -38.33 18.83 Favored 'Trans proline' 0 C--N 1.352 0.761 0 CA-C-N 121.437 1.549 . . . . 0.0 110.731 170.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.14 -35.11 71.03 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 121.024 -1.047 . . . . 0.0 112.743 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 35.3 ttt180 -63.4 -47.62 81.23 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.879 1.272 . . . . 0.0 110.379 172.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.06 -34.72 73.77 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.258 1.408 . . . . 0.0 114.148 177.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -75.64 -32.8 60.37 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.356 1.078 . . . . 0.0 110.725 175.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.96 -46.69 64.73 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.734 -0.604 . . . . 0.0 110.968 -177.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.53 -35.35 77.34 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.37 -53.45 56.45 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.488 0.586 . . . . 0.0 112.064 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 88.4 mt -58.47 -34.1 70.5 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.246 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 44.1 ttp -65.53 -50.5 64.99 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.294 0.638 . . . . 0.0 112.469 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -64.65 -44.35 90.72 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.145 0.884 . . . . 0.0 112.172 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.2 -38.79 90.47 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.145 0.978 . . . . 0.0 111.426 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -62.92 -45.99 89.88 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.152 -0.968 . . . . 0.0 111.777 171.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 70.3 mt -64.96 -34.84 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 121.277 -0.89 . . . . 0.0 112.561 -177.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -61.51 -65.14 0.74 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.715 1.206 . . . . 0.0 110.356 169.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 12.4 m-30 -76.26 -2.94 33.87 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.893 1.277 . . . . 0.0 114.234 -171.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -55.73 -31.72 62.75 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.636 1.575 . . . . 0.0 112.035 170.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -89.22 126.21 35.4 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.443 1.097 . . . . 0.0 110.152 171.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -77.44 68.81 3.61 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.93 -0.481 . . . . 0.0 110.917 169.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 33.1 mt . . . . . 0 CA--C 1.547 0.855 0 C-N-CA 128.805 2.842 . . . . 0.0 118.183 175.309 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 24.0 m80 . . . . . 0 N--CA 1.469 0.5 0 CA-C-O 120.686 0.279 . . . . 0.0 111.393 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.6 tp -134.68 87.1 32.09 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 124.65 1.18 . . . . 0.0 110.94 177.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -64.95 145.72 86.18 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 121.865 1.71 . . . . 0.0 109.868 165.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 t -152.73 131.4 12.32 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 121.242 -0.911 . . . . 0.0 112.832 -167.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 55.9 p -87.7 51.45 2.22 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.94 1.696 . . . . 0.0 113.337 -176.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -80.42 160.7 25.25 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.257 -0.902 . . . . 0.0 112.395 172.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.82 128.03 32.94 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 167.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -69.81 93.39 0.39 Allowed Glycine 0 CA--C 1.535 1.326 0 C-N-CA 123.823 0.725 . . . . 0.0 113.745 -173.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.9 t -151.61 161.98 41.76 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.111 1.364 . . . . 0.0 111.93 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 53.9 m -78.05 161.35 27.51 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.389 1.076 . . . . 0.0 112.937 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.0 m -122.67 140.94 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 125.157 1.383 . . . . 0.0 111.987 -178.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -80.27 30.49 0.28 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.68 1.192 . . . . 0.0 113.213 173.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -73.11 31.24 0.78 Allowed Glycine 0 CA--C 1.538 1.519 0 O-C-N 120.105 -1.622 . . . . 0.0 116.564 -167.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.0 t -82.96 56.71 3.56 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 119.294 1.547 . . . . 0.0 113.662 -170.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -66.31 170.28 6.15 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.161 -0.962 . . . . 0.0 112.573 173.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.1 p -110.38 161.1 15.98 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.959 1.304 . . . . 0.0 113.418 176.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.9 t -123.27 135.56 62.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 125.701 1.6 . . . . 0.0 109.748 -175.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -80.42 173.66 12.38 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.571 1.549 . . . . 0.0 112.767 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.5 -28.73 32.61 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -170.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.8 m -128.88 43.42 3.15 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.588 1.955 . . . . 0.0 111.029 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.25 -122.12 5.84 Favored Glycine 0 CA--C 1.528 0.9 0 O-C-N 120.938 -1.101 . . . . 0.0 111.288 -174.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 56.12 -176.58 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.319 1.048 . . . . 0.0 113.562 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mt -110.1 133.63 53.01 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.214 -0.928 . . . . 0.0 109.575 173.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 12.8 mt -106.31 144.36 33.12 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 122.005 0.907 . . . . 0.0 110.693 169.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 23.4 mt -64.95 113.63 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 124.151 0.98 . . . . 0.0 110.238 -173.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -143.19 142.09 31.33 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.205 1.402 . . . . 0.0 111.344 -175.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 27.0 ttm180 -65.88 -25.49 67.2 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.507 1.123 . . . . 0.0 112.972 -173.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.43 -29.89 68.08 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 128.649 2.78 . . . . 0.0 112.334 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 82.1 mt -56.27 -39.06 57.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.336 1.054 . . . . 0.0 111.647 173.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -68.22 -35.88 78.66 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 121.006 -1.059 . . . . 0.0 112.362 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -66.23 -31.31 72.05 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.058 0.543 . . . . 0.0 111.251 173.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.36 -44.63 78.53 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.944 0.897 . . . . 0.0 111.457 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -63.87 -44.96 91.5 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 118.285 -0.864 . . . . 0.0 113.176 167.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -39.79 94.48 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 120.624 1.556 . . . . 0.0 112.453 -177.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.94 -13.05 42.8 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -113.95 -12.17 12.68 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.546 1.138 . . . . 0.0 113.241 172.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 34.0 mt -78.9 -39.53 34.72 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.385 0.993 . . . . 0.0 111.484 172.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.1 p -66.86 -41.09 87.91 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.986 0.812 . . . . 0.0 110.95 171.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -83.58 21.38 1.23 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.022 1.729 . . . . 0.0 114.603 176.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 12.0 p -55.07 -33.39 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 C-N-CA 124.763 1.225 . . . . 0.0 113.683 -173.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 123.33 115.93 2.25 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.708 1.146 . . . . 0.0 113.298 170.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -73.3 -18.73 61.17 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.138 0.975 . . . . 0.0 112.951 175.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -145.99 -59.85 0.02 OUTLIER Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 127.848 2.459 . . . . 0.0 112.279 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.43 53.32 4.5 Favored 'Trans proline' 0 CA--C 1.548 1.182 0 C-N-CA 123.946 3.098 . . . . 0.0 114.489 -170.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 40.2 tp -51.88 -47.64 64.42 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.913 1.685 . . . . 0.0 113.23 -177.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -58.86 -35.24 72.63 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.291 1.036 . . . . 0.0 112.621 177.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -79.87 -31.93 40.41 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.231 -0.918 . . . . 0.0 112.169 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.4 t -65.48 -43.52 90.0 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 122.762 0.425 . . . . 0.0 111.877 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.17 -35.53 81.1 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 121.921 -0.487 . . . . 0.0 111.514 173.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -65.87 -46.06 79.84 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.957 0.503 . . . . 0.0 110.519 -176.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 19.5 ptt-85 -64.74 -31.08 72.15 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 117.846 -1.073 . . . . 0.0 113.356 171.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.21 -61.27 2.48 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.563 1.074 . . . . 0.0 109.995 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -59.35 -29.69 67.85 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.508 1.123 . . . . 0.0 113.189 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.03 -45.21 71.03 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.602 0.761 . . . . 0.0 112.183 173.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -53.42 -48.97 68.26 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.066 0.946 . . . . 0.0 112.597 176.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.422 HG21 ' HG3' ' A' ' 129' ' ' ARG . 3.9 mp -62.12 -38.62 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 O-C-N 121.372 -0.83 . . . . 0.0 111.864 175.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.66 -24.63 61.06 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -83.64 -42.37 16.76 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.684 1.194 . . . . 0.0 112.486 173.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -79.12 -46.94 17.01 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.702 1.201 . . . . 0.0 113.04 -178.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -88.27 171.77 9.93 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 122.654 1.216 . . . . 0.0 110.935 177.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.92 -108.16 0.09 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.736 1.215 . . . . 0.0 111.749 -176.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 47.7 tt0 -126.68 -63.9 0.02 OUTLIER Pre-proline 0 N--CA 1.47 0.552 0 O-C-N 120.337 -1.477 . . . . 0.0 108.975 -175.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.78 -38.37 10.35 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 120.764 1.309 . . . . 0.0 111.568 173.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.9 -29.65 68.49 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.028 -1.045 . . . . 0.0 111.957 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.422 ' HG3' HG21 ' A' ' 120' ' ' ILE . 51.6 ttt180 -72.73 -45.45 58.63 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.942 0.401 . . . . 0.0 110.183 177.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.57 -35.49 80.73 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 115.459 -0.792 . . . . 0.0 113.762 176.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -72.65 -34.59 67.38 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.467 1.134 . . . . 0.0 110.747 175.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.03 -44.02 61.31 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.167 0.587 . . . . 0.0 111.285 -174.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -69.6 -36.18 75.98 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 119.032 -0.508 . . . . 0.0 112.074 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.66 -53.56 54.55 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.067 0.849 . . . . 0.0 111.782 174.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.4 mt -56.29 -35.29 67.34 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.679 0.792 . . . . 0.0 111.501 175.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 53.4 ttp -66.86 -51.3 57.12 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.434 0.693 . . . . 0.0 112.561 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -64.44 -40.8 96.44 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.436 -0.79 . . . . 0.0 111.66 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.06 -43.68 98.3 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.84 1.256 . . . . 0.0 111.377 176.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -60.35 -45.21 94.28 Favored 'General case' 0 C--O 1.221 -0.426 0 O-C-N 121.636 -0.665 . . . . 0.0 111.241 173.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 85.5 mt -67.94 -34.34 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.743 0.817 . . . . 0.0 112.861 -178.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -69.58 -49.69 51.75 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.617 0.767 . . . . 0.0 111.406 172.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 14.0 m-30 -79.93 -0.42 34.96 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.125 -0.984 . . . . 0.0 113.49 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -56.84 -26.21 57.84 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 126.441 1.896 . . . . 0.0 113.316 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -159.07 139.67 12.47 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.715 1.606 . . . . 0.0 112.418 167.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -86.0 18.71 2.89 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 125.162 1.385 . . . . 0.0 112.479 165.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 47.8 mt . . . . . 0 N--CA 1.479 1.011 0 C-N-CA 128.023 2.529 . . . . 0.0 116.719 178.425 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 . . . . . 0 CA--C 1.545 0.781 0 CA-C-O 119.317 -0.373 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 27.6 tp -124.62 68.53 52.35 Favored Pre-proline 0 CA--C 1.557 1.237 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -167.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -62.91 125.08 15.18 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.974 2.449 . . . . 0.0 111.396 177.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 8.9 p -158.32 161.29 37.63 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 126.545 1.938 . . . . 0.0 110.79 -169.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 79.5 p -69.68 145.2 52.55 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.091 0.86 . . . . 0.0 113.098 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.3 p90 -163.02 171.66 16.16 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.507 1.523 . . . . 0.0 111.977 173.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 17.6 mtt180 -88.86 -57.77 2.79 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 125.152 1.381 . . . . 0.0 112.741 167.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -163.19 21.99 0.17 Allowed Glycine 0 CA--C 1.534 1.239 0 N-CA-C 116.377 1.311 . . . . 0.0 116.377 -175.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.2 p 48.41 37.58 9.07 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 115.429 1.64 . . . . 0.0 115.429 173.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 44.7 t -109.45 141.72 41.47 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.087 1.355 . . . . 0.0 111.444 176.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 16.4 m -149.24 142.35 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 126.728 2.011 . . . . 0.0 110.183 177.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -94.51 24.79 4.31 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.023 1.329 . . . . 0.0 113.304 176.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.18 118.38 14.07 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.434 1.016 . . . . 0.0 112.776 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.4 t -150.63 21.83 0.81 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.072 1.749 . . . . 0.0 113.405 -165.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -50.08 156.66 0.75 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 128.509 2.724 . . . . 0.0 114.432 175.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.7 p -106.27 157.81 17.32 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.547 1.139 . . . . 0.0 112.995 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.5 t -124.45 129.92 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.374 1.47 . . . . 0.0 110.0 -171.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -77.32 171.01 15.53 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.985 2.114 . . . . 0.0 113.138 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.14 2.71 0.08 Allowed 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 127.72 2.408 . . . . 0.0 116.373 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 42.7 m -154.05 37.26 0.44 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.529 1.931 . . . . 0.0 111.31 169.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.84 -103.84 3.1 Favored Glycine 0 CA--C 1.527 0.789 0 O-C-N 120.872 -1.143 . . . . 0.0 111.854 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 49.89 -166.89 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.304 1.442 . . . . 0.0 112.88 -172.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mt -122.56 129.99 52.53 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 120.598 -1.314 . . . . 0.0 108.214 162.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.8 mt -99.66 143.3 30.05 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.996 0.903 . . . . 0.0 111.388 174.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 48.3 mm -61.31 125.04 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 123.901 0.88 . . . . 0.0 110.91 -174.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.5 p -155.39 150.6 26.9 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.487 1.915 . . . . 0.0 110.335 -168.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 30.3 ttm180 -88.45 -12.16 43.91 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 -168.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -67.87 -29.38 68.48 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 117.613 -1.184 . . . . 0.0 111.803 169.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 45.4 mm -51.62 -36.56 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 119.972 1.26 . . . . 0.0 112.064 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.4 ttt85 -74.58 -41.16 60.99 Favored 'General case' 0 CA--C 1.521 -0.15 0 O-C-N 121.007 -1.058 . . . . 0.0 110.775 178.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -64.78 -28.28 69.47 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.437 176.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 tt -64.77 -47.75 77.01 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.478 1.511 . . . . 0.0 110.866 174.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -66.68 -42.3 86.75 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.61 -0.682 . . . . 0.0 112.451 171.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -58.12 -43.91 87.44 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.574 1.079 . . . . 0.0 112.842 177.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.69 -34.33 75.57 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -175.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -88.04 -32.19 18.91 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.525 1.13 . . . . 0.0 113.001 178.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.8 mt -57.21 -51.06 70.87 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.824 1.193 . . . . 0.0 110.696 170.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 62.6 m -68.69 -6.28 25.26 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.75 -2.89 24.28 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.795 1.406 . . . . 0.0 114.795 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 4.4 p -91.08 -47.41 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 119.88 1.218 . . . . 0.0 112.948 176.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 59.81 -111.39 3.48 Favored Glycine 0 CA--C 1.536 1.372 0 CA-C-N 119.031 0.832 . . . . 0.0 111.77 -173.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -106.73 7.79 30.61 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.011 1.324 . . . . 0.0 113.475 174.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -70.2 160.45 80.76 Favored Pre-proline 0 N--CA 1.464 0.267 0 O-C-N 120.054 -1.653 . . . . 0.0 111.331 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -69.83 131.3 20.86 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 122.324 2.016 . . . . 0.0 111.886 174.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.12 -26.77 66.51 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.377 1.071 . . . . 0.0 112.335 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 25.9 mm100 -50.85 -54.08 26.86 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.225 1.41 . . . . 0.0 114.219 -174.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.57 -33.1 58.5 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.022 -1.049 . . . . 0.0 113.499 176.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 50.4 m -60.61 -38.88 86.16 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.547 0.739 . . . . 0.0 111.575 178.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.29 -32.85 59.01 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 118.507 -0.758 . . . . 0.0 111.528 173.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.58 -47.07 83.02 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.569 0.622 . . . . 0.0 110.508 -175.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.71 -39.34 84.37 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.42 -0.8 . . . . 0.0 112.94 172.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 35.2 tp -59.65 -57.71 11.77 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.542 1.065 . . . . 0.0 111.917 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -23.24 66.76 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.61 -31.14 32.63 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.316 1.046 . . . . 0.0 113.04 176.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.66 -44.45 56.77 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.546 0.739 . . . . 0.0 110.484 173.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 15.3 mt -57.59 -41.26 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 CA-C-O 121.525 0.679 . . . . 0.0 111.533 173.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.46 -21.31 66.63 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -95.02 -23.12 17.5 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 176.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -90.64 -40.35 11.95 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 35.3 mt -83.81 179.7 7.51 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.776 2.031 . . . . 0.0 113.301 177.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -91.43 -96.05 0.12 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.63 1.172 . . . . 0.0 112.167 -173.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -140.85 -62.22 0.02 OUTLIER Pre-proline 0 N--CA 1.47 0.558 0 O-C-N 120.716 -1.24 . . . . 0.0 109.956 170.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.57 -35.76 36.73 Favored 'Trans proline' 0 C--N 1.352 0.761 0 CA-C-N 121.276 1.491 . . . . 0.0 111.106 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -47.84 -47.74 31.25 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.999 1.319 . . . . 0.0 112.628 168.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -62.76 -48.03 80.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.965 1.306 . . . . 0.0 110.458 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.13 -34.77 74.43 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.568 1.08 . . . . 0.0 113.649 178.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -75.77 -33.48 60.2 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.483 1.142 . . . . 0.0 110.986 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.2 61.2 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.691 -0.63 . . . . 0.0 111.055 -174.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -67.05 -36.84 82.94 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.967 173.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.11 -55.18 35.45 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 119.378 0.99 . . . . 0.0 111.312 175.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 92.4 mt -53.79 -36.63 62.64 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.283 1.033 . . . . 0.0 111.847 174.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 40.9 ttp -67.2 -50.6 60.3 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.648 0.658 . . . . 0.0 112.353 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -43.58 93.39 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.454 -0.778 . . . . 0.0 111.271 177.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -39.09 93.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.604 1.562 . . . . 0.0 112.377 178.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -64.06 -39.99 95.28 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.167 -0.958 . . . . 0.0 111.985 173.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 83.9 mt -72.18 -35.07 51.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.233 1.013 . . . . 0.0 112.059 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 62.0 t0 -62.42 -62.59 1.65 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.07 2.148 . . . . 0.0 110.81 172.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -78.87 -1.21 33.96 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -177.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 23.0 ttmt -48.67 -45.13 38.4 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.715 1.206 . . . . 0.0 112.878 -173.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.05 161.93 39.5 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 127.841 2.456 . . . . 0.0 112.871 -178.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 56.08 34.3 23.53 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.679 1.192 . . . . 0.0 111.686 -177.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 24.9 mt . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 117.044 2.239 . . . . 0.0 117.044 175.95 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 73.2 m80 . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.6 tt -160.88 82.61 2.03 Favored Pre-proline 0 CA--C 1.558 1.276 0 C-N-CA 125.836 1.655 . . . . 0.0 110.759 172.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -79.46 131.24 9.39 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.231 2.621 . . . . 0.0 113.188 -175.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.4 p -56.09 -56.66 18.08 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -158.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.8 t -163.84 -174.75 3.77 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.934 1.294 . . . . 0.0 111.462 -175.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -63.68 -59.48 4.54 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.5 1.12 . . . . 0.0 111.579 173.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 50.3 mtt180 -147.8 130.04 15.59 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.517 1.927 . . . . 0.0 109.891 175.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.94 165.38 8.92 Favored Glycine 0 CA--C 1.538 1.504 0 C-N-CA 124.999 1.285 . . . . 0.0 114.935 -178.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 26.9 p -107.99 78.82 1.21 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.223 1.409 . . . . 0.0 110.652 175.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.8 m -131.21 133.71 45.76 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.344 1.058 . . . . 0.0 111.446 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -145.52 152.96 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 126.902 2.081 . . . . 0.0 108.786 171.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -85.02 -100.66 0.06 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.231 0.613 . . . . 0.0 110.437 175.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.58 29.03 33.78 Favored Glycine 0 CA--C 1.542 1.735 0 O-C-N 120.841 -1.162 . . . . 0.0 113.789 -176.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.3 t -76.21 34.77 0.13 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.816 1.246 . . . . 0.0 113.403 170.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -77.53 -176.02 4.07 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.917 1.287 . . . . 0.0 112.083 176.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.5 p -147.36 166.42 27.19 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 120.574 -1.328 . . . . 0.0 112.772 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 p -135.66 130.28 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.063 1.745 . . . . 0.0 111.379 -165.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -75.38 168.97 18.98 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.701 2.0 . . . . 0.0 112.548 172.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -50.29 -17.25 0.42 Allowed 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 -176.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.9 m -139.09 41.9 2.09 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 127.411 2.285 . . . . 0.0 111.674 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 92.38 -123.93 7.48 Favored Glycine 0 C--N 1.35 1.338 0 O-C-N 119.524 -1.985 . . . . 0.0 110.372 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 62.7 m-20 55.92 -178.94 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.584 1.153 . . . . 0.0 112.677 -171.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.48 114.84 28.22 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 172.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 12.1 mt -83.49 148.39 27.26 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 122.161 0.981 . . . . 0.0 111.951 175.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 22.9 mt -66.51 101.19 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.612 1.165 . . . . 0.0 110.089 -173.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -145.96 138.96 25.84 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.652 1.581 . . . . 0.0 110.086 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 34.5 ttp180 -78.29 42.35 0.41 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.119 1.368 . . . . 0.0 113.739 -170.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.33 -59.59 2.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.292 1.037 . . . . 0.0 113.317 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.0 pt -54.31 -31.3 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.426 1.49 . . . . 0.0 114.297 -167.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -60.09 -40.43 89.58 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.644 -0.66 . . . . 0.0 112.299 176.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -73.82 -32.39 63.68 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.52 0.728 . . . . 0.0 109.741 -173.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.1 mp -60.77 -51.01 71.16 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.619 0.767 . . . . 0.0 110.885 167.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.6 m-30 -60.17 -45.27 93.67 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 118.382 -0.818 . . . . 0.0 112.292 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -62.68 -38.05 88.83 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.536 1.134 . . . . 0.0 112.659 178.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.11 -41.29 97.3 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.206 0.912 . . . . 0.0 111.902 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -84.61 -28.24 26.65 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.571 -0.705 . . . . 0.0 112.665 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 43.8 mt -59.01 -33.29 70.55 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.643 1.11 . . . . 0.0 111.195 166.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.2 m -82.47 9.06 9.96 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.595 1.558 . . . . 0.0 113.952 175.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -149.4 38.8 0.79 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 126.042 1.737 . . . . 0.0 112.969 -174.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 9.1 p -141.2 3.39 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 C-N-CA 125.443 1.497 . . . . 0.0 113.891 -177.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -92.74 -20.16 35.06 Favored Glycine 0 CA--C 1.538 1.501 0 O-C-N 120.938 -1.101 . . . . 0.0 114.757 176.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -107.64 -32.44 7.67 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.734 1.214 . . . . 0.0 111.04 171.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -74.01 149.76 87.67 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 125.861 1.664 . . . . 0.0 114.045 -176.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -66.98 119.55 6.58 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.742 2.294 . . . . 0.0 111.438 171.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -51.61 -44.32 62.85 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 127.307 2.243 . . . . 0.0 111.895 -172.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -58.98 -39.84 82.98 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.973 1.309 . . . . 0.0 113.176 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -85.61 -36.11 20.56 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 121.595 -0.691 . . . . 0.0 111.884 -178.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 78.6 p -63.24 -41.48 99.08 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.119 178.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.29 -33.86 73.83 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.781 0.719 . . . . 0.0 112.493 176.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.79 -44.69 76.78 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.568 0.622 . . . . 0.0 111.956 -171.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 33.2 ptt180 -70.09 -32.68 70.86 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 118.625 -0.702 . . . . 0.0 112.881 171.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.4 tt -57.52 -60.38 3.75 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.966 0.803 . . . . 0.0 109.991 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.56 -31.92 66.6 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.804 0.841 . . . . 0.0 112.162 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.4 -37.52 80.41 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.118 0.567 . . . . 0.0 112.173 -177.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -61.18 -50.13 74.37 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.492 171.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.15 -39.49 80.68 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.413 0 CA-C-N 119.161 0.891 . . . . 0.0 111.578 177.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.85 -21.46 63.35 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -99.59 -21.38 15.9 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.73 1.212 . . . . 0.0 114.167 176.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -104.68 -38.12 6.83 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 120.357 -0.537 . . . . 0.0 112.237 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -87.67 156.63 19.38 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 122.491 1.139 . . . . 0.0 110.096 169.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.61 -88.47 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.944 0.898 . . . . 0.0 112.371 -166.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -150.07 -58.48 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.735 0 O-C-N 121.096 -1.003 . . . . 0.0 111.01 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -69.66 -36.24 11.43 Favored 'Trans proline' 0 C--N 1.353 0.776 0 CA-C-N 121.637 1.621 . . . . 0.0 111.113 167.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.97 -39.46 81.81 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 120.945 -1.097 . . . . 0.0 111.847 173.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 43.2 ttt180 -60.4 -51.24 70.33 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.211 1.405 . . . . 0.0 110.167 172.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -60.0 -31.02 71.32 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.018 1.294 . . . . 0.0 114.57 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.68 -30.23 41.05 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.768 1.284 . . . . 0.0 111.039 173.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.92 -44.3 55.51 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.414 -0.804 . . . . 0.0 111.138 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -66.99 -34.78 78.5 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 174.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.54 -56.36 22.27 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.003 0.521 . . . . 0.0 111.206 172.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.9 mp -58.45 -33.18 69.44 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.568 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 49.8 ttp -63.3 -48.21 79.03 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.708 0.803 . . . . 0.0 112.887 175.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -75.36 -29.54 59.94 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 120.761 -1.212 . . . . 0.0 112.775 176.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -41.99 76.63 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 124.873 1.269 . . . . 0.0 110.703 -178.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -35.24 79.63 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.687 -0.633 . . . . 0.0 111.072 176.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 87.8 mt -65.77 -40.31 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.797 0.839 . . . . 0.0 110.952 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -60.01 -19.28 51.73 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.442 1.097 . . . . 0.0 113.918 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -118.77 3.84 11.6 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.414 1.485 . . . . 0.0 114.385 176.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 11.9 tppt? -71.12 -46.0 62.53 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.663 1.185 . . . . 0.0 112.234 -177.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -103.31 145.34 30.1 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.22 1.808 . . . . 0.0 112.013 -175.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -74.2 73.68 1.78 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 122.993 0.517 . . . . 0.0 112.266 176.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 68.1 mt . . . . . 0 CA--C 1.548 0.886 0 C-N-CA 125.981 1.712 . . . . 0.0 114.757 170.509 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 35.9 t-80 . . . . . 0 CA--C 1.545 0.769 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 11.5 tp 66.43 140.1 0.06 OUTLIER Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 127.896 2.478 . . . . 0.0 112.674 -169.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -63.54 117.97 4.91 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 CA-C-N 120.49 1.211 . . . . 0.0 109.076 162.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.6 p -123.33 137.3 54.87 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 121.604 0.716 . . . . 0.0 112.795 -178.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.1 m -119.3 49.31 1.36 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.557 1.943 . . . . 0.0 109.593 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -132.22 167.17 20.28 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.681 1.192 . . . . 0.0 111.166 -171.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 54.3 mtp85 -57.67 0.25 0.06 Allowed 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 118.194 2.664 . . . . 0.0 118.194 -169.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 56.46 37.65 75.94 Favored Glycine 0 N--CA 1.477 1.37 0 CA-C-N 120.159 1.345 . . . . 0.0 115.824 163.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 t -157.24 -177.81 6.89 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.389 1.475 . . . . 0.0 111.911 -169.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 80.2 p -64.46 145.38 56.18 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.516 1.527 . . . . 0.0 113.55 177.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.2 m -82.2 154.02 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 123.34 0.656 . . . . 0.0 112.244 167.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -73.86 64.0 0.94 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.13 2.172 . . . . 0.0 111.998 173.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -117.95 91.61 0.53 Allowed Glycine 0 CA--C 1.533 1.166 0 C-N-CA 125.658 1.599 . . . . 0.0 112.393 175.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.3 t -134.78 16.89 3.57 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 127.926 2.49 . . . . 0.0 113.864 -176.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -51.48 170.27 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 129.388 3.075 . . . . 0.0 115.517 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.6 p -107.52 162.89 13.53 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.449 1.5 . . . . 0.0 113.82 173.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.6 t -130.07 135.88 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.106 1.762 . . . . 0.0 109.728 -173.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -80.2 174.77 11.26 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.445 1.498 . . . . 0.0 112.406 177.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.52 -13.31 1.47 Allowed 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 116.279 1.955 . . . . 0.0 116.279 -172.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 9.4 m -151.7 54.54 0.84 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.12 1.768 . . . . 0.0 111.027 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.0 -120.8 5.4 Favored Glycine 0 CA--C 1.527 0.795 0 O-C-N 121.191 -0.943 . . . . 0.0 111.049 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 55.1 -178.81 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.107 0 CA-C-N 118.067 0.933 . . . . 0.0 112.329 -168.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -108.82 123.4 48.99 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.555 -1.341 . . . . 0.0 108.098 166.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.8 mt -87.08 147.79 25.53 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 120.253 1.388 . . . . 0.0 111.06 173.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 42.5 mm -67.67 95.93 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.495 1.118 . . . . 0.0 110.932 -176.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.7 p -136.2 142.78 44.13 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.085 1.354 . . . . 0.0 110.804 173.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.5 ttm180 -68.52 13.13 0.1 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.331 1.452 . . . . 0.0 114.805 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -62.88 -63.44 1.21 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.529 1.531 . . . . 0.0 112.495 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 45.7 pt -55.53 -26.88 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 126.236 1.814 . . . . 0.0 115.644 -169.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -65.79 -33.33 75.61 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.932 -1.105 . . . . 0.0 112.53 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -71.5 -35.44 70.77 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.527 0.731 . . . . 0.0 110.422 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tt -63.99 -49.46 72.4 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.059 1.344 . . . . 0.0 110.595 175.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -58.04 -46.83 84.71 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.047 -0.978 . . . . 0.0 113.154 170.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -64.43 -37.94 89.27 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 120.96 1.709 . . . . 0.0 112.148 -178.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.48 -41.51 89.93 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.473 -0.767 . . . . 0.0 112.361 176.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -89.26 -13.55 37.88 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 67.3 mt -74.64 -35.78 62.87 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.613 1.097 . . . . 0.0 111.455 163.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.9 t -67.53 -48.16 67.8 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.798 0.839 . . . . 0.0 111.39 170.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -93.02 30.33 1.64 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.739 1.216 . . . . 0.0 113.608 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.3 p -67.03 -26.8 37.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 -171.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 125.29 126.02 2.97 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 125.484 1.516 . . . . 0.0 113.884 171.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -67.83 -23.23 65.15 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.797 1.239 . . . . 0.0 113.717 173.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -154.52 -58.25 0.02 OUTLIER Pre-proline 0 CA--C 1.553 1.081 0 C-N-CA 126.449 1.899 . . . . 0.0 113.724 174.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -77.41 59.94 6.86 Favored 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 124.218 3.279 . . . . 0.0 114.392 -172.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.24 -25.36 61.6 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 126.294 1.838 . . . . 0.0 113.724 -174.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.42 -25.69 68.12 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 120.721 -1.237 . . . . 0.0 114.198 177.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -92.03 -34.99 14.19 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.561 1.073 . . . . 0.0 113.442 -174.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 66.2 p -61.24 -44.98 96.37 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.681 -0.637 . . . . 0.0 110.749 175.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -36.21 83.6 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.271 0.628 . . . . 0.0 112.089 176.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -63.43 -44.31 94.96 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.412 0.685 . . . . 0.0 111.442 -176.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -72.88 -42.39 63.7 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.496 0.718 . . . . 0.0 111.642 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 57.3 tp -51.45 -59.93 3.7 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.909 0.883 . . . . 0.0 111.875 174.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.7 ppt_? -64.57 -20.95 66.55 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.03 -1.044 . . . . 0.0 113.526 -177.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -74.47 -45.84 43.5 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 124.123 0.889 . . . . 0.0 112.181 169.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -57.43 -50.9 71.53 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 118.962 0.801 . . . . 0.0 112.284 177.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.0 mp -59.79 -41.78 86.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 119.587 1.085 . . . . 0.0 111.598 177.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.07 -32.8 73.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.41 33.06 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.179 -0.951 . . . . 0.0 110.645 175.114 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -71.61 -53.23 14.34 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.257 0.623 . . . . 0.0 112.303 -174.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.1 mt -81.1 166.54 20.61 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.162 0.506 . . . . 0.0 111.566 174.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -85.12 -87.46 0.12 Allowed 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -165.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -143.02 -62.83 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.127 1.371 . . . . 0.0 109.782 169.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -64.54 -37.23 39.03 Favored 'Trans proline' 0 C--N 1.356 0.926 0 CA-C-N 121.993 1.748 . . . . 0.0 112.27 177.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.04 -38.37 65.14 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.028 -1.045 . . . . 0.0 112.529 172.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -49.27 78.42 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.959 1.704 . . . . 0.0 110.557 176.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.8 -32.83 70.83 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 126.771 2.129 . . . . 0.0 114.32 175.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -78.26 -30.59 48.68 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.721 1.26 . . . . 0.0 110.909 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.76 -46.44 62.94 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.841 0.746 . . . . 0.0 111.306 -177.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.8 pp -64.9 -39.36 93.41 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.755 0.422 . . . . 0.0 111.898 174.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.62 -52.69 62.35 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.654 -0.654 . . . . 0.0 112.308 175.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.5 -29.45 69.09 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 117.877 -1.058 . . . . 0.0 111.817 176.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 46.3 ttp -66.65 -50.91 61.42 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.475 1.034 . . . . 0.0 111.771 174.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -67.68 -38.78 84.19 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.301 -0.874 . . . . 0.0 112.127 178.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.18 -41.21 94.84 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.988 1.315 . . . . 0.0 112.016 176.063 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -59.71 -37.51 79.08 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 121.331 -0.856 . . . . 0.0 111.503 172.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 84.1 mt -72.79 -40.98 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 123.834 0.854 . . . . 0.0 112.004 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -57.79 -51.12 70.88 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.528 1.131 . . . . 0.0 111.289 170.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 7.5 m-30 -89.13 11.38 18.75 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.384 1.074 . . . . 0.0 113.289 -176.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -65.29 -30.29 71.13 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.355 1.062 . . . . 0.0 112.358 178.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 36.2 pttt -159.03 150.11 20.14 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.247 1.819 . . . . 0.0 112.302 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -73.89 61.32 0.78 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.706 1.202 . . . . 0.0 111.478 168.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 7.0 mp . . . . . 0 CA--C 1.545 0.761 0 C-N-CA 128.961 2.904 . . . . 0.0 114.19 -170.005 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 23.5 m170 . . . . . 0 CA--C 1.544 0.742 0 CA-C-O 121.306 0.574 . . . . 0.0 111.717 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.57 87.35 3.39 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 124.359 1.064 . . . . 0.0 111.83 -179.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -74.53 -172.09 1.1 Allowed 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 123.96 3.107 . . . . 0.0 112.112 166.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 82.7 p -63.51 174.04 1.44 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 128.069 2.547 . . . . 0.0 116.069 -169.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.4 t 66.77 37.62 4.12 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 126.616 1.966 . . . . 0.0 115.197 -177.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 20.5 p90 -122.45 160.72 24.94 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.837 1.655 . . . . 0.0 111.557 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -165.51 162.56 19.3 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 127.041 2.136 . . . . 0.0 109.726 172.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -164.13 167.94 38.35 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 123.947 0.784 . . . . 0.0 112.999 -178.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 75.8 p -110.5 48.14 0.93 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.904 1.282 . . . . 0.0 112.963 -168.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 t 53.66 41.95 31.96 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.375 1.47 . . . . 0.0 114.315 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 24.0 m -89.91 172.67 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 125.492 1.517 . . . . 0.0 112.567 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -160.7 134.62 7.0 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.73 2.012 . . . . 0.0 107.489 171.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.91 76.66 0.07 OUTLIER Glycine 0 CA--C 1.53 1.017 0 C-N-CA 126.213 1.863 . . . . 0.0 113.427 172.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.6 t -75.92 27.61 0.11 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.892 1.677 . . . . 0.0 113.846 176.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -65.47 164.6 13.59 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.61 1.564 . . . . 0.0 112.205 177.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.7 p -120.36 156.15 31.93 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.702 1.201 . . . . 0.0 112.517 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.4 t -121.62 128.85 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 125.77 1.628 . . . . 0.0 108.624 -173.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -76.61 179.84 5.73 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.291 1.036 . . . . 0.0 112.636 176.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.73 -29.25 17.78 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 -168.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.3 m -143.55 84.85 1.82 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.654 1.582 . . . . 0.0 109.22 169.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 67.15 -124.3 22.63 Favored Glycine 0 CA--C 1.533 1.199 0 O-C-N 122.07 -0.394 . . . . 0.0 113.086 -177.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 57.31 178.92 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.858 1.263 . . . . 0.0 113.235 -168.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -113.05 125.76 54.74 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 164.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.6 mt -85.7 158.56 20.02 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 118.848 0.749 . . . . 0.0 110.228 169.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 39.8 mm -69.77 119.81 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.421 0.688 . . . . 0.0 110.437 179.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.7 p -147.46 162.16 39.6 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.733 0.813 . . . . 0.0 111.383 177.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -92.05 -19.79 21.98 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.922 -0.486 . . . . 0.0 111.815 -175.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.6 -29.5 37.98 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 173.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.0 mm -55.05 -34.93 33.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 O-C-N 120.794 -1.191 . . . . 0.0 111.433 -177.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -84.77 -18.67 34.33 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 121.171 -0.956 . . . . 0.0 111.613 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -73.77 -30.04 62.54 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.208 0.603 . . . . 0.0 110.501 173.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.8 mp -66.54 -57.01 8.18 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.428 0.558 . . . . 0.0 110.853 171.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -53.66 -46.55 70.63 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.346 177.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -60.66 -40.31 91.59 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.517 1.053 . . . . 0.0 112.715 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.41 -46.29 87.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.139 -0.975 . . . . 0.0 112.333 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -78.78 -21.12 48.3 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.0 mt -69.05 -37.1 78.37 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 119.439 1.018 . . . . 0.0 112.574 171.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.0 t -71.57 -37.21 71.06 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 119.152 0.887 . . . . 0.0 112.154 171.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -81.9 2.92 28.25 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 177.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 9.9 p -60.7 -29.45 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 116.265 1.95 . . . . 0.0 116.265 -155.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 102.54 171.15 26.81 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 124.501 1.048 . . . . 0.0 114.797 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -147.2 -58.28 0.27 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.417 1.487 . . . . 0.0 110.745 -176.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -80.52 -62.97 0.36 Allowed Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 123.527 0.731 . . . . 0.0 111.814 167.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -74.88 141.34 26.89 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.676 2.251 . . . . 0.0 110.348 168.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -141.06 -41.56 0.39 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.629 1.171 . . . . 0.0 110.356 177.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -54.63 -40.33 68.84 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.695 1.198 . . . . 0.0 112.769 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 28.6 mp0 -72.16 -43.4 64.68 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.002 -1.061 . . . . 0.0 113.048 178.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 28.0 t -54.77 -49.65 70.38 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.853 0.861 . . . . 0.0 110.614 175.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.97 -37.58 72.78 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 117.578 -1.201 . . . . 0.0 112.752 178.035 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -57.96 -51.07 71.17 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 120.125 1.329 . . . . 0.0 110.633 178.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -72.77 -37.6 67.57 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 117.998 -1.001 . . . . 0.0 111.577 -176.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 52.3 tp -54.98 -63.67 1.08 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.524 0.73 . . . . 0.0 111.558 173.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.76 -22.28 66.83 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 117.523 -1.227 . . . . 0.0 113.427 -177.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.92 -44.71 54.23 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 124.21 0.944 . . . . 0.0 112.287 168.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -53.17 -50.53 64.4 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.75 1.22 . . . . 0.0 112.315 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.0 mp -60.72 -39.37 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 O-C-N 121.63 -0.669 . . . . 0.0 111.955 177.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -75.2 -15.95 60.52 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -98.57 -35.39 10.23 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.127 1.371 . . . . 0.0 113.296 175.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -82.91 -39.41 21.53 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.917 0.887 . . . . 0.0 112.214 175.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 83.6 mt -93.95 168.32 11.04 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.387 1.089 . . . . 0.0 112.285 168.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.9 -91.35 0.09 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.63 1.172 . . . . 0.0 112.31 -164.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -146.07 -55.12 0.02 OUTLIER Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.932 1.293 . . . . 0.0 111.281 173.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -68.34 -43.32 4.49 Favored 'Trans proline' 0 C--N 1.356 0.949 0 CA-C-N 121.921 1.722 . . . . 0.0 111.726 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -48.92 -39.47 26.27 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.648 1.579 . . . . 0.0 113.142 173.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.87 -45.13 95.79 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.183 1.393 . . . . 0.0 111.355 176.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.95 -35.17 82.11 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 125.485 1.517 . . . . 0.0 113.707 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -73.73 -32.92 64.1 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.362 1.081 . . . . 0.0 110.68 174.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.09 -45.0 62.35 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.173 0.589 . . . . 0.0 111.565 -176.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.07 -37.06 80.84 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.338 0.655 . . . . 0.0 112.259 175.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.9 -51.51 66.67 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.304 0.502 . . . . 0.0 112.012 173.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.7 mp -58.37 -30.1 66.52 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 117.874 -1.06 . . . . 0.0 111.646 175.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -57.36 10.17 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.067 0.848 . . . . 0.0 111.483 175.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.72 -37.24 84.29 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.215 -0.928 . . . . 0.0 112.395 179.368 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -38.95 92.71 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.189 1.396 . . . . 0.0 112.203 173.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -65.32 -43.19 91.81 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.368 -0.832 . . . . 0.0 111.27 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 55.6 mt -62.43 -38.76 82.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-O 118.406 -0.807 . . . . 0.0 112.419 -178.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -57.2 -23.05 45.17 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.963 0.905 . . . . 0.0 112.786 175.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -118.1 6.6 12.08 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.381 1.472 . . . . 0.0 114.455 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -79.61 -17.41 53.91 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.64 1.176 . . . . 0.0 113.857 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -96.95 137.07 36.6 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.987 1.315 . . . . 0.0 109.545 173.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -73.45 91.24 1.76 Allowed 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.419 -0.801 . . . . 0.0 110.946 177.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 9.3 mp . . . . . 0 N--CA 1.477 0.884 0 C-N-CA 128.484 2.713 . . . . 0.0 116.898 169.872 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 . . . . . 0 CA--C 1.556 1.182 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 25.6 tp -128.59 74.52 80.24 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 125.878 1.671 . . . . 0.0 112.096 -168.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -80.68 -31.15 1.58 Allowed 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 123.114 2.543 . . . . 0.0 113.578 178.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 22.2 p -92.66 116.44 29.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.987 1.315 . . . . 0.0 112.133 -173.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.6 m -136.94 154.69 50.38 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.147 1.779 . . . . 0.0 111.349 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -59.95 109.8 1.03 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.442 1.097 . . . . 0.0 113.207 -172.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 55.48 22.48 5.1 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 125.585 1.554 . . . . 0.0 113.005 -174.038 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 107.46 -164.3 13.05 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 125.175 1.369 . . . . 0.0 112.986 -173.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.5 p -91.33 17.66 8.12 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.835 1.654 . . . . 0.0 114.208 -175.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.5 m -77.23 54.25 1.08 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 126.235 1.814 . . . . 0.0 115.507 -170.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.3 m -93.85 144.3 9.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 124.432 1.093 . . . . 0.0 111.751 171.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -67.12 -43.18 83.1 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 121.443 -0.786 . . . . 0.0 112.449 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.17 39.76 81.91 Favored Glycine 0 N--CA 1.475 1.236 0 C-N-CA 124.969 1.271 . . . . 0.0 114.356 171.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.4 t -139.72 55.53 1.66 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.785 1.279 . . . . 0.0 109.71 -152.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -95.6 161.19 14.15 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 127.399 2.279 . . . . 0.0 112.228 177.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 p -92.23 155.35 18.04 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.597 1.559 . . . . 0.0 113.259 171.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 27.7 m -131.75 159.48 43.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 125.998 1.719 . . . . 0.0 110.438 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -91.35 -178.95 5.27 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.043 1.737 . . . . 0.0 112.715 -177.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.72 15.62 0.1 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.113 1.765 . . . . 0.0 115.528 -173.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.5 m -160.49 38.93 0.17 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.966 2.107 . . . . 0.0 110.547 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.69 -122.51 7.16 Favored Glycine 0 CA--C 1.529 0.961 0 O-C-N 121.035 -1.041 . . . . 0.0 110.981 -166.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 57.07 -174.9 0.07 Allowed 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 118.182 0.991 . . . . 0.0 112.996 -171.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.2 mt -108.58 134.56 51.17 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.942 0.897 . . . . 0.0 108.985 171.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.7 164.3 12.64 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.715 0.806 . . . . 0.0 111.374 175.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 39.3 mm -66.43 108.86 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.025 0.93 . . . . 0.0 111.231 175.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 10.1 t -155.93 162.96 40.31 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.838 1.255 . . . . 0.0 111.675 170.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -94.26 9.09 39.42 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -57.03 -46.14 82.62 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 121.156 -0.965 . . . . 0.0 111.981 172.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.5 pt -56.46 -33.33 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.519 1.128 . . . . 0.0 113.622 178.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 40.0 ttt85 -61.33 -45.1 95.84 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 118.696 0.68 . . . . 0.0 110.706 173.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -68.01 -33.4 74.55 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.153 0.581 . . . . 0.0 111.334 -178.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.3 mp -62.82 -52.56 62.68 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.843 0.747 . . . . 0.0 112.017 168.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.71 -42.9 98.16 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.306 0.957 . . . . 0.0 112.749 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -62.94 -43.88 97.6 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.526 1.057 . . . . 0.0 111.717 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.81 -36.72 79.78 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -90.2 -24.77 20.91 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 31.6 mt -63.59 -44.63 93.46 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 119.308 0.958 . . . . 0.0 111.544 173.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.9 t -72.95 -26.41 61.37 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.65 -11.8 61.13 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 115.887 1.81 . . . . 0.0 115.887 -177.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 8.0 p -67.46 -38.97 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 119.793 1.178 . . . . 0.0 114.062 -172.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 56.01 -132.96 50.84 Favored Glycine 0 CA--C 1.538 1.514 0 O-C-N 121.702 -0.624 . . . . 0.0 112.803 -174.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -105.89 -2.35 23.09 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 124.725 1.21 . . . . 0.0 113.687 172.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -70.71 153.43 94.9 Favored Pre-proline 0 CA--C 1.543 0.673 0 C-N-CA 125.096 1.358 . . . . 0.0 111.536 178.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -64.57 115.75 3.39 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 121.851 1.701 . . . . 0.0 112.08 -173.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.1 tt -50.97 -28.59 10.18 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.43 1.892 . . . . 0.0 112.483 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -48.33 -29.63 4.12 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.701 1.6 . . . . 0.0 113.979 171.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -89.64 -40.18 12.74 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 176.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 89.1 p -68.05 -37.12 80.95 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 121.289 -0.882 . . . . 0.0 111.506 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.5 pp -65.09 -34.17 77.77 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 118.996 -0.526 . . . . 0.0 111.886 173.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -64.92 -45.39 86.04 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.265 0.555 . . . . 0.0 111.816 -175.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 18.3 mmt85 -64.2 -43.62 94.46 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.112 0.565 . . . . 0.0 110.721 171.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 54.8 tp -56.1 -56.16 24.18 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.434 0.694 . . . . 0.0 112.153 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -55.77 -37.01 67.98 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 119.256 0.935 . . . . 0.0 112.285 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.71 -41.35 92.41 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.807 0.843 . . . . 0.0 112.431 178.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -61.58 -49.04 78.26 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 118.558 -0.734 . . . . 0.0 111.958 173.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.5 mp -57.94 -45.81 87.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.794 1.179 . . . . 0.0 111.195 175.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.84 -32.96 74.9 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -80.64 -45.77 16.7 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.997 0.817 . . . . 0.0 112.708 177.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -66.0 -51.87 54.44 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.993 1.317 . . . . 0.0 112.985 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.9 -160.92 0.15 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.836 1.255 . . . . 0.0 112.102 -178.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.54 -105.48 0.39 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.08 1.352 . . . . 0.0 109.239 173.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 56.7 tt0 -127.54 -64.38 0.02 OUTLIER Pre-proline 0 N--CA 1.468 0.464 0 O-C-N 120.126 -1.609 . . . . 0.0 110.162 -176.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -67.08 -30.95 37.8 Favored 'Trans proline' 0 C--N 1.349 0.574 0 CA-C-N 121.206 1.467 . . . . 0.0 111.561 173.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.6 -35.41 80.41 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 120.794 -1.191 . . . . 0.0 112.267 172.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -64.55 -47.3 79.3 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.971 0.908 . . . . 0.0 110.125 170.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.8 -34.54 78.1 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.138 1.352 . . . . 0.0 114.008 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -33.15 64.84 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.812 1.306 . . . . 0.0 110.041 175.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.38 -43.42 60.62 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.372 0.669 . . . . 0.0 111.558 -174.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -69.49 -35.54 75.67 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.094 0.557 . . . . 0.0 112.439 174.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.84 -50.51 70.65 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 122.937 0.495 . . . . 0.0 111.923 172.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.7 mp -57.79 -31.98 67.1 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 117.619 -1.182 . . . . 0.0 111.916 173.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 2.3 tpt -64.53 -52.32 58.34 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.611 1.096 . . . . 0.0 111.137 174.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 38.3 mm-40 -62.4 -43.08 99.66 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.104 0.562 . . . . 0.0 112.46 177.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -41.82 86.23 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.64 1.176 . . . . 0.0 111.985 -179.405 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -60.88 -42.68 98.4 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.852 0.751 . . . . 0.0 111.332 170.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 68.3 mt -62.5 -28.74 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-O 119.182 -0.437 . . . . 0.0 111.089 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -76.9 -31.21 56.57 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.656 -176.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.3 p90 -102.55 3.31 37.28 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 174.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 9.9 ttpt -54.17 -29.24 44.86 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.465 1.506 . . . . 0.0 113.585 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.75 148.21 28.96 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.125 1.37 . . . . 0.0 112.546 169.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -74.6 39.2 0.12 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 124.906 1.282 . . . . 0.0 112.32 165.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 7.3 mp . . . . . 0 N--CA 1.475 0.793 0 C-N-CA 129.966 3.307 . . . . 0.0 115.553 -167.322 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 21.6 m80 . . . . . 0 CA--C 1.539 0.549 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 39.5 mt -141.01 63.31 18.25 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.12 1.368 . . . . 0.0 111.272 171.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -61.78 140.21 84.53 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 122.373 2.049 . . . . 0.0 111.36 175.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.4 p -75.64 18.52 0.23 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.58 1.952 . . . . 0.0 115.46 -164.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 73.9 m -71.66 85.15 0.89 Allowed 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.87 -1.144 . . . . 0.0 110.942 177.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -158.58 30.61 0.23 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.539 1.135 . . . . 0.0 113.004 -176.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.9 mmt85 59.48 -14.64 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 118.173 2.656 . . . . 0.0 118.173 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 126.8 109.74 1.63 Allowed Glycine 0 CA--C 1.53 1.018 0 C-N-CA 127.109 2.29 . . . . 0.0 110.765 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.1 p -60.02 -46.83 88.2 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -154.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.2 m 54.66 13.96 0.78 Allowed 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 16.7 m -64.35 151.58 9.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 126.521 1.928 . . . . 0.0 113.808 -171.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -77.22 -57.1 4.02 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 61.48 17.54 53.6 Favored Glycine 0 CA--C 1.541 1.718 0 C-N-CA 124.534 1.064 . . . . 0.0 115.73 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.6 t -79.83 28.74 0.27 Allowed 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.583 1.553 . . . . 0.0 114.308 -175.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -67.66 161.88 24.88 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.803 1.241 . . . . 0.0 112.788 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 73.4 p -147.52 163.17 37.41 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.958 0.903 . . . . 0.0 113.201 -178.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.8 p -127.99 130.2 69.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.675 1.59 . . . . 0.0 111.975 -167.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -82.75 178.9 7.96 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.653 1.581 . . . . 0.0 113.336 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.43 -7.01 0.2 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.483 2.313 . . . . 0.0 117.203 -173.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.3 m -161.53 75.84 0.5 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 126.041 1.736 . . . . 0.0 109.864 161.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 73.58 -127.3 10.47 Favored Glycine 0 CA--C 1.528 0.874 0 O-C-N 121.169 -0.957 . . . . 0.0 110.939 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 57.84 175.95 0.05 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.357 1.063 . . . . 0.0 111.372 -166.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.4 125.84 52.2 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.629 -1.294 . . . . 0.0 108.26 167.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.9 mt -84.29 166.33 17.56 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 118.925 0.784 . . . . 0.0 111.959 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 38.2 mm -73.49 94.96 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 124.583 1.153 . . . . 0.0 112.127 -173.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 46.3 p -138.03 148.05 44.74 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.933 1.693 . . . . 0.0 111.58 177.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.31 6.04 48.33 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -174.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -59.48 -39.01 82.37 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.979 0.912 . . . . 0.0 110.906 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 32.8 pt -55.53 -37.09 44.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 125.792 1.637 . . . . 0.0 113.356 176.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 -61.18 -55.22 34.73 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.238 1.015 . . . . 0.0 109.888 176.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -66.48 -31.81 72.78 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.534 0.733 . . . . 0.0 112.305 -179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 8.7 mt -62.51 -53.4 55.26 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.165 0.986 . . . . 0.0 112.497 172.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -59.8 -46.24 89.83 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.68 0.673 . . . . 0.0 110.867 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -65.16 -34.17 77.74 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -177.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.02 -44.7 79.62 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.149 -0.97 . . . . 0.0 112.664 173.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -74.62 -31.22 61.93 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.495 -0.753 . . . . 0.0 112.293 179.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.0 mt -63.49 -39.84 95.5 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.814 0.734 . . . . 0.0 110.465 169.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 34.1 m -67.74 -3.17 8.51 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 172.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -112.46 0.5 15.58 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.794 1.638 . . . . 0.0 113.606 172.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.3 p -66.8 -11.8 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 -168.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -59.99 -68.26 1.76 Allowed Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.335 1.445 . . . . 0.0 113.434 -178.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -67.64 169.67 9.03 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 118.149 0.975 . . . . 0.0 111.396 172.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 57.37 153.44 0.08 OUTLIER Pre-proline 0 N--CA 1.49 1.553 0 C-N-CA 127.328 2.251 . . . . 0.0 117.0 -173.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -69.3 144.63 57.14 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 121.815 1.677 . . . . 0.0 110.534 163.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -49.12 -41.67 36.69 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.601 1.16 . . . . 0.0 112.662 -178.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -58.99 -29.96 67.61 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.74 1.216 . . . . 0.0 113.688 -178.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -85.04 -43.35 14.01 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.01 0.823 . . . . 0.0 111.968 178.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 48.1 t -59.72 -43.15 94.3 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 123.767 0.827 . . . . 0.0 111.343 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.3 pp -68.91 -35.46 76.86 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.605 -0.712 . . . . 0.0 112.307 174.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.78 -45.81 92.28 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.379 0.991 . . . . 0.0 110.637 178.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -57.63 -45.16 85.76 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.872 0.869 . . . . 0.0 111.642 174.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 38.7 tp -62.65 -56.57 16.56 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.515 0.726 . . . . 0.0 112.461 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -22.52 65.54 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.179 -0.951 . . . . 0.0 113.328 -177.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -72.64 -40.17 66.61 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.137 0.975 . . . . 0.0 113.126 174.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -42.9 74.06 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.647 0.658 . . . . 0.0 110.486 177.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 17.8 mt -57.06 -40.97 76.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 121.575 -0.703 . . . . 0.0 110.955 173.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.85 -23.15 64.2 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -79.34 -29.63 42.33 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 174.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -107.37 -37.5 6.21 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -170.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -88.51 156.72 18.93 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.291 1.436 . . . . 0.0 111.664 175.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -75.98 -69.03 0.52 Allowed 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 -157.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -165.21 -56.82 0.01 OUTLIER Pre-proline 0 N--CA 1.479 0.985 0 C-N-CA 127.147 2.179 . . . . 0.0 109.794 168.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -69.78 -39.69 6.16 Favored 'Trans proline' 0 C--N 1.356 0.927 0 CA-C-N 121.446 1.552 . . . . 0.0 111.498 173.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.34 -40.26 61.72 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.75 1.22 . . . . 0.0 112.35 175.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -60.23 -48.36 82.04 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.493 1.517 . . . . 0.0 111.163 174.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.52 -34.05 74.23 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.52 1.533 . . . . 0.0 113.625 177.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -73.83 -34.46 64.56 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.437 1.118 . . . . 0.0 110.906 175.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.78 -46.61 68.29 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 122.876 0.47 . . . . 0.0 110.902 -176.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -71.08 -33.57 70.33 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 175.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.17 -53.02 59.82 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 118.826 0.739 . . . . 0.0 112.257 173.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.16 -34.22 70.06 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.673 0.789 . . . . 0.0 111.242 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 48.3 ttp -64.93 -52.93 53.68 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.601 0.761 . . . . 0.0 112.37 175.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -64.81 -37.64 88.3 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.587 -0.696 . . . . 0.0 112.428 178.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -43.35 94.85 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.344 1.058 . . . . 0.0 112.309 175.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.438 ' O ' ' HE2' ' A' ' 143' ' ' LYS . 73.4 t80 -59.93 -39.47 85.6 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.44 -0.788 . . . . 0.0 111.465 175.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 88.3 mt -72.16 -41.87 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.079 1.351 . . . . 0.0 112.867 176.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -55.0 -53.24 58.26 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.134 1.374 . . . . 0.0 110.028 172.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -79.52 7.93 7.29 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 120.935 -1.103 . . . . 0.0 113.231 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.438 ' HE2' ' O ' ' A' ' 139' ' ' TYR . 0.0 OUTLIER -78.62 -29.63 46.03 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.093 0.957 . . . . 0.0 112.679 166.77 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -85.16 141.58 30.08 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.54 1.136 . . . . 0.0 112.373 178.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -98.11 13.76 29.93 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.564 1.546 . . . . 0.0 114.228 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 28.7 mt . . . . . 0 N--CA 1.482 1.151 0 C-N-CA 128.138 2.575 . . . . 0.0 116.444 179.713 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 . . . . . 0 CA--C 1.537 0.479 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -115.5 150.35 44.48 Favored Pre-proline 0 N--CA 1.476 0.856 0 C-N-CA 124.509 1.124 . . . . 0.0 111.958 -175.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -79.24 -10.21 15.01 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 122.903 2.402 . . . . 0.0 115.281 -173.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.1 t -127.25 156.1 42.42 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.85 1.26 . . . . 0.0 112.995 -167.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 77.2 p -90.34 -166.69 1.64 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.11 1.364 . . . . 0.0 113.422 -173.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -139.75 157.38 45.84 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.367 1.867 . . . . 0.0 109.635 178.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -82.44 151.08 26.72 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 172.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -76.1 49.61 2.58 Favored Glycine 0 CA--C 1.535 1.314 0 N-CA-C 116.085 1.194 . . . . 0.0 116.085 -171.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.1 t -88.57 139.65 30.26 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.928 1.291 . . . . 0.0 112.615 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.2 p -84.01 87.49 7.13 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.003 1.321 . . . . 0.0 111.681 179.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.4 131.46 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-O 121.418 0.628 . . . . 0.0 111.404 172.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -74.6 -47.16 33.94 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.664 1.585 . . . . 0.0 112.51 -178.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 65.65 35.32 90.93 Favored Glycine 0 CA--C 1.541 1.691 0 CA-C-O 118.461 -1.189 . . . . 0.0 113.308 -172.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.8 t -112.59 131.31 55.68 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.333 1.453 . . . . 0.0 113.385 -166.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -169.79 178.09 4.19 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.217 1.807 . . . . 0.0 110.4 -176.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.48 ' HG ' ' CB ' ' A' ' 88' ' ' LEU . 53.9 p -137.11 159.67 41.21 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.739 1.216 . . . . 0.0 112.644 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.0 p -128.33 130.92 69.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 126.52 1.928 . . . . 0.0 111.52 -169.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -77.95 170.03 17.28 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 126.203 1.801 . . . . 0.0 111.644 173.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.34 -1.79 0.15 Allowed 'General case' 0 CA--C 1.558 1.265 0 N-CA-C 117.071 2.248 . . . . 0.0 117.071 -173.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 18.0 m -147.38 39.42 0.99 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.534 1.933 . . . . 0.0 112.094 175.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 86.94 -121.15 5.69 Favored Glycine 0 C--N 1.342 0.913 0 N-CA-C 109.951 -1.259 . . . . 0.0 109.951 -173.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 57.37 175.47 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.091 0.956 . . . . 0.0 112.764 -166.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.44 120.55 42.21 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 164.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.48 ' CB ' ' HG ' ' A' ' 80' ' ' SER . 9.0 mt -84.15 161.0 20.76 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.14 0.882 . . . . 0.0 110.922 170.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 17.9 mt -75.17 99.08 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 124.301 1.04 . . . . 0.0 110.888 -173.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 31.9 p -113.18 155.48 24.94 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.842 0.857 . . . . 0.0 110.595 162.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.524 ' O ' ' HG2' ' A' ' 94' ' ' ARG . 1.5 tpm_? -72.02 -33.08 67.76 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.206 -0.934 . . . . 0.0 111.469 173.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.473 ' HA ' HD21 ' A' ' 95' ' ' ASN . 3.3 m-20 -53.36 -34.55 58.02 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 127.198 2.199 . . . . 0.0 113.447 -167.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 55.3 mt -44.38 -35.97 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 126.424 1.89 . . . . 0.0 112.782 173.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.524 ' HG2' ' O ' ' A' ' 91' ' ' ARG . 19.9 ptt85 -79.9 -24.92 40.8 Favored 'General case' 0 C--N 1.339 0.137 0 O-C-N 121.494 -0.754 . . . . 0.0 111.829 -173.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.473 HD21 ' HA ' ' A' ' 92' ' ' ASP . 68.1 m-80 -73.61 -30.73 63.17 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.175 0.99 . . . . 0.0 110.019 175.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.4 -45.09 89.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.738 0.815 . . . . 0.0 111.425 172.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -60.99 -47.96 84.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 118.127 -0.94 . . . . 0.0 112.715 170.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.7 -41.67 97.9 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 120.355 1.434 . . . . 0.0 112.148 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.24 -22.68 63.33 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 177.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -106.31 -22.49 12.81 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.3 mt -64.05 -51.16 65.43 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.977 1.262 . . . . 0.0 109.833 171.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.8 m -71.21 8.34 1.02 Allowed 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 172.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -134.58 14.99 3.7 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.876 1.27 . . . . 0.0 113.716 176.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 8.4 p -76.87 -25.02 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.372 1.069 . . . . 0.0 113.503 -178.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.8 -10.31 19.34 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 124.922 1.248 . . . . 0.0 115.874 -179.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 62.49 -24.51 0.05 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 128.596 2.758 . . . . 0.0 117.202 175.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -105.89 -43.59 0.15 Allowed Pre-proline 0 CA--C 1.561 1.381 0 C-N-CA 125.116 1.366 . . . . 0.0 114.629 169.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -84.01 67.99 6.81 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.186 3.257 . . . . 0.0 112.825 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.68 8.73 1.05 Allowed 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -174.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -94.72 -69.8 0.74 Allowed 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.219 -1.55 . . . . 0.0 112.089 -178.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -70.36 -19.04 63.07 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 120.136 -1.602 . . . . 0.0 114.201 -171.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.0 p -65.13 -44.18 89.5 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 124.378 1.071 . . . . 0.0 111.63 171.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.8 -36.87 67.66 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 118.45 0.568 . . . . 0.0 111.88 175.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -63.65 -42.95 98.06 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.413 0.551 . . . . 0.0 112.067 -169.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 38.8 ptt85 -73.5 -32.37 64.24 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 172.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 43.9 tp -65.23 -58.26 6.4 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.998 0.817 . . . . 0.0 111.013 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.85 -30.81 67.98 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.334 -0.854 . . . . 0.0 112.017 178.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.97 -44.05 81.47 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 122.89 0.476 . . . . 0.0 111.988 174.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -53.36 -56.4 17.03 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.341 1.057 . . . . 0.0 112.049 173.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.2 mp -60.54 -41.03 86.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 121.637 -0.664 . . . . 0.0 111.562 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.18 -24.22 64.94 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.31 -33.2 16.19 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.96 0.904 . . . . 0.0 113.062 173.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.54 -48.84 14.43 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.397 1.479 . . . . 0.0 113.342 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -92.36 155.15 18.1 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.66 1.584 . . . . 0.0 111.049 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -76.42 -74.16 0.24 Allowed 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 114.967 -1.015 . . . . 0.0 113.47 -159.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -158.12 -58.43 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.704 0 C-N-CA 125.102 1.361 . . . . 0.0 110.377 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -70.16 -41.22 3.94 Favored 'Trans proline' 0 C--N 1.353 0.81 0 CA-C-N 121.047 1.41 . . . . 0.0 111.321 171.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.25 -37.47 67.26 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.926 1.29 . . . . 0.0 113.12 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 20.1 ttt-85 -56.59 -50.93 70.52 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.253 1.821 . . . . 0.0 111.104 172.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.72 -30.54 62.8 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.408 1.48 . . . . 0.0 114.376 177.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -80.77 -30.6 36.0 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.412 1.106 . . . . 0.0 111.598 173.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.55 -45.9 64.59 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.635 -0.666 . . . . 0.0 111.043 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -66.34 -34.46 78.03 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.253 0.621 . . . . 0.0 112.638 174.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.0 -54.38 35.26 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.123 0.569 . . . . 0.0 112.124 173.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 65.7 mt -55.31 -38.17 68.34 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.673 0.789 . . . . 0.0 111.051 178.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 60.1 ttp -63.43 -53.79 46.68 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.068 0.947 . . . . 0.0 112.014 177.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -69.71 -32.24 70.71 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.009 -1.057 . . . . 0.0 113.258 -178.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -45.13 95.43 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.679 1.192 . . . . 0.0 110.932 169.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -61.81 -45.08 95.4 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.155 -0.965 . . . . 0.0 111.639 174.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 71.1 mt -61.66 -38.41 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.173 0.989 . . . . 0.0 112.076 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -58.11 -54.74 43.49 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.373 1.469 . . . . 0.0 111.471 173.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -86.01 1.23 51.03 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 120.122 -1.611 . . . . 0.0 113.04 -174.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -54.7 -50.67 67.74 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.22 1.008 . . . . 0.0 110.424 173.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -59.99 161.49 6.63 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.105 1.362 . . . . 0.0 112.946 175.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.85 86.59 2.49 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.812 0.815 . . . . 0.0 112.212 -176.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 41.5 mt . . . . . 0 N--CA 1.48 1.035 0 C-N-CA 127.083 2.153 . . . . 0.0 116.649 174.056 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 33.2 m170 . . . . . 0 CA--C 1.544 0.75 0 CA-C-O 120.497 0.189 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 mp 64.5 160.29 0.12 Allowed Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 127.984 2.514 . . . . 0.0 115.955 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -78.42 -45.38 0.13 Allowed 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 123.022 2.482 . . . . 0.0 113.192 178.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.6 p -154.43 151.05 28.54 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 127.185 2.194 . . . . 0.0 109.811 178.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.8 t -79.37 -177.97 6.01 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 122.933 0.493 . . . . 0.0 111.382 169.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -81.28 172.49 13.54 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.321 1.048 . . . . 0.0 113.264 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 21.3 ttt180 -125.75 154.72 42.1 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.294 176.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.33 -164.0 31.74 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 115.968 -0.56 . . . . 0.0 113.684 -173.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.1 t -142.82 -4.55 0.94 Allowed 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.8 m -82.9 58.3 4.28 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.936 1.694 . . . . 0.0 113.393 -170.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 23.0 m -111.16 160.48 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 124.797 1.239 . . . . 0.0 111.62 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -106.62 -69.36 0.84 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.17 0.15 14.35 Favored Glycine 0 CA--C 1.539 1.564 0 N-CA-C 117.625 1.81 . . . . 0.0 117.625 168.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.3 t -117.4 51.54 1.02 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.485 1.642 . . . . 0.0 112.34 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -68.71 168.64 12.81 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.039 1.336 . . . . 0.0 114.205 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.1 p -84.68 162.59 19.64 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.369 1.468 . . . . 0.0 114.032 176.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.3 p -145.28 140.63 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 125.254 1.422 . . . . 0.0 111.122 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -80.96 174.65 11.41 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.459 1.904 . . . . 0.0 111.881 175.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.94 -6.94 0.64 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.71 2.004 . . . . 0.0 115.791 -177.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 26.9 m -156.87 59.34 0.53 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.56 1.944 . . . . 0.0 110.758 169.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.11 -115.98 4.22 Favored Glycine 0 C--N 1.341 0.85 0 O-C-N 121.18 -0.95 . . . . 0.0 111.482 178.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 28.5 m-20 52.36 -177.03 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.748 1.619 . . . . 0.0 113.006 -174.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.4 mt -114.6 119.46 36.84 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 120.342 -1.474 . . . . 0.0 109.777 167.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.8 mt -85.04 149.19 25.75 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.632 0.773 . . . . 0.0 110.246 172.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 15.0 mt -81.77 112.45 19.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 123.525 0.73 . . . . 0.0 110.137 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 6.4 t -155.0 176.51 12.44 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.3 1.04 . . . . 0.0 112.202 169.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -68.31 -15.15 63.46 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -165.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.17 -32.41 73.79 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.751 1.159 . . . . 0.0 112.234 -177.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.7 mt -63.51 -36.47 76.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.384 0.673 . . . . 0.0 111.743 -170.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -59.67 -52.02 67.29 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.619 -0.676 . . . . 0.0 110.494 170.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -62.43 -30.63 71.37 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.32 1.048 . . . . 0.0 112.296 -179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -53.51 56.39 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.087 0.955 . . . . 0.0 111.759 174.067 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -65.62 -43.23 90.19 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.373 176.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -40.06 89.7 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.338 0.972 . . . . 0.0 112.167 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.92 -38.18 84.86 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.51 -0.744 . . . . 0.0 112.586 -178.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -93.28 -21.11 19.79 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 32.1 mt -66.35 -23.35 66.33 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.58 1.082 . . . . 0.0 113.489 173.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 41.6 t -76.36 -39.71 53.12 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 121.719 -0.613 . . . . 0.0 112.44 164.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -77.1 33.39 0.15 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.546 1.938 . . . . 0.0 114.416 -176.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 3.0 p -135.86 1.56 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 126.398 1.879 . . . . 0.0 113.618 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -85.55 -59.56 1.9 Allowed Glycine 0 CA--C 1.531 1.082 0 O-C-N 121.074 -1.016 . . . . 0.0 113.132 173.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -82.67 -18.69 40.13 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -179.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.11 142.69 25.57 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 125.902 1.681 . . . . 0.0 110.713 175.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -68.41 150.5 75.82 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.072 1.848 . . . . 0.0 113.099 178.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.87 -45.36 40.86 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.516 1.927 . . . . 0.0 111.896 -178.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 12.5 tp-100 -57.47 -33.34 67.88 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.934 1.294 . . . . 0.0 113.924 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -86.53 -42.02 13.87 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 119.26 0.936 . . . . 0.0 112.57 174.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 20.7 t -56.26 -45.58 80.02 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 123.655 0.597 . . . . 0.0 111.322 179.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.55 -37.11 85.76 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 176.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -64.38 -48.47 75.34 Favored 'General case' 0 C--N 1.34 0.196 0 C-N-CA 123.31 0.644 . . . . 0.0 110.43 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -65.97 -37.45 86.02 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.625 174.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.5 tt -60.74 -65.03 0.75 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.377 0.989 . . . . 0.0 111.018 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.85 -27.61 69.29 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.42 1.088 . . . . 0.0 112.896 -176.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -75.25 -40.27 59.08 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -41.81 95.62 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 174.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 7.4 mt -62.08 -40.39 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.466 -0.771 . . . . 0.0 112.104 172.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.89 -28.0 64.22 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -77.84 -26.29 49.31 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.115 0.966 . . . . 0.0 113.55 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -107.71 -52.88 2.7 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.123 1.369 . . . . 0.0 114.176 -172.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -82.95 130.99 35.2 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.582 -1.324 . . . . 0.0 110.347 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -59.61 -77.27 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 114.287 -1.324 . . . . 0.0 112.881 -158.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -155.47 -61.27 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 125.021 1.328 . . . . 0.0 110.23 174.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -68.52 -37.67 12.51 Favored 'Trans proline' 0 C--N 1.352 0.752 0 CA-C-N 121.501 1.572 . . . . 0.0 110.485 172.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.56 -44.29 65.77 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.145 0.978 . . . . 0.0 111.445 171.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -60.5 -51.47 69.31 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.608 1.963 . . . . 0.0 111.309 178.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -60.69 -30.1 71.58 Favored Glycine 0 CA--C 1.526 0.778 0 C-N-CA 125.387 1.47 . . . . 0.0 114.02 177.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -77.29 -33.7 55.72 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.565 1.183 . . . . 0.0 111.09 172.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.99 -46.15 68.79 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.343 -0.848 . . . . 0.0 111.045 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -69.04 -34.13 74.71 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 176.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.45 -53.16 56.46 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.251 0.621 . . . . 0.0 111.901 172.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.4 mt -55.57 -34.35 64.69 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.074 0.949 . . . . 0.0 111.413 175.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 36.9 ttp -65.86 -53.41 40.19 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 118.634 0.652 . . . . 0.0 112.12 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -59.72 -44.73 93.6 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.701 -0.624 . . . . 0.0 112.56 176.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -45.22 94.32 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.45 1.1 . . . . 0.0 111.389 178.113 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -58.62 -46.32 87.3 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.886 -0.509 . . . . 0.0 111.3 174.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 68.3 mt -61.76 -46.79 95.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 123.741 0.816 . . . . 0.0 111.32 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -65.62 -34.4 78.14 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.948 1.299 . . . . 0.0 112.252 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -91.75 -3.77 55.8 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 176.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -60.3 -43.49 96.24 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 120.995 -1.066 . . . . 0.0 113.115 -171.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.41 148.81 16.67 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.258 1.823 . . . . 0.0 113.098 178.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -135.69 85.06 2.13 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.071 0.948 . . . . 0.0 111.703 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 38.1 mt . . . . . 0 N--CA 1.48 1.047 0 C-N-CA 127.983 2.513 . . . . 0.0 117.261 176.171 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 . . . . . 0 CA--C 1.541 0.608 0 CA-C-O 120.467 0.175 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.676 ' HG ' HH21 ' A' ' 115' ' ' ARG . 18.3 tp 45.4 57.8 15.36 Favored Pre-proline 0 CA--C 1.557 1.22 0 C-N-CA 128.099 2.56 . . . . 0.0 115.415 170.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.37 164.61 22.56 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.741 2.961 . . . . 0.0 115.266 -172.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 73.3 p -90.96 88.36 6.99 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 126.496 1.918 . . . . 0.0 112.017 -174.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.0 m -68.95 34.8 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.383 1.473 . . . . 0.0 114.592 175.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -153.58 152.11 30.53 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.733 -1.229 . . . . 0.0 113.199 -169.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -55.58 -11.82 1.01 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 118.181 2.66 . . . . 0.0 118.181 -177.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 99.31 106.78 2.73 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 125.739 1.638 . . . . 0.0 111.664 -171.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.0 t -157.99 171.05 20.96 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 126.057 1.743 . . . . 0.0 110.863 -174.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 89.3 p -150.51 168.32 24.57 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.552 1.541 . . . . 0.0 112.294 -176.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 32.6 m -115.77 156.19 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 125.858 1.663 . . . . 0.0 110.259 176.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -50.93 -47.98 60.9 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -172.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.24 13.32 59.94 Favored Glycine 0 CA--C 1.538 1.472 0 N-CA-C 115.824 1.09 . . . . 0.0 115.824 174.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.0 t -106.82 29.71 6.76 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.433 1.493 . . . . 0.0 113.219 -171.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -64.28 158.92 22.05 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.954 1.702 . . . . 0.0 113.915 -175.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.3 p -116.42 165.48 13.17 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -170.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.4 p -140.32 131.84 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 126.702 2.001 . . . . 0.0 111.145 -165.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -81.92 174.21 11.49 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.17 0.988 . . . . 0.0 112.069 172.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.71 -7.95 0.34 Allowed 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 117.136 2.273 . . . . 0.0 117.136 -171.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.4 t -145.84 48.64 1.23 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.716 1.207 . . . . 0.0 111.729 171.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.58 -121.83 5.55 Favored Glycine 0 CA--C 1.528 0.856 0 O-C-N 120.626 -1.296 . . . . 0.0 110.463 -174.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 57.9 -176.69 0.07 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.169 0.988 . . . . 0.0 111.32 -168.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -115.03 119.84 37.84 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.055 -1.028 . . . . 0.0 108.432 170.116 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.2 mt -84.2 135.73 34.25 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 119.156 0.889 . . . . 0.0 110.46 174.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 24.4 mt -66.14 102.14 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 124.265 1.026 . . . . 0.0 109.899 -174.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.6 p -142.46 156.67 45.19 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.228 1.811 . . . . 0.0 110.689 -175.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 30.0 ttt180 -66.38 -21.66 66.23 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -159.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -51.65 -45.73 63.45 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.54 1.536 . . . . 0.0 113.281 -174.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.0 pt -60.32 -28.31 41.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -177.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.3 ttt85 -65.03 -48.42 73.92 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.056 0.844 . . . . 0.0 110.941 173.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -69.88 -33.88 72.82 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.651 0.38 . . . . 0.0 111.885 -179.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.7 mp -56.64 -54.42 46.2 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 118.29 0.496 . . . . 0.0 112.026 171.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -64.46 -39.11 93.2 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.89 -30.82 62.82 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.752 1.16 . . . . 0.0 112.909 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.03 -30.77 71.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 175.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -91.0 -12.43 35.88 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 175.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.9 mt -80.32 -38.89 29.74 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 171.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.6 m -74.9 134.24 41.64 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 178.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 61.0 23.65 13.8 Favored 'General case' 0 CA--C 1.554 1.115 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 175.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.449 ' CG2' ' HG ' ' A' ' 112' ' ' SER . 9.4 p -54.14 -22.08 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.343 0 N-CA-C 116.8 2.148 . . . . 0.0 116.8 -169.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.69 -43.02 1.83 Allowed Glycine 0 CA--C 1.537 1.426 0 C-N-CA 125.81 1.671 . . . . 0.0 116.679 168.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -97.26 134.55 40.42 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.093 1.357 . . . . 0.0 110.764 168.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -61.19 -44.7 94.53 Favored Pre-proline 0 CA--C 1.548 0.874 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 173.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -82.81 117.29 2.61 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.489 2.126 . . . . 0.0 110.529 171.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.81 -10.9 1.88 Allowed 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 174.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -47.83 -35.07 9.59 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.648 1.579 . . . . 0.0 113.678 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -86.22 -46.44 10.36 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.449 ' HG ' ' CG2' ' A' ' 104' ' ' VAL . 63.6 p -69.55 -33.49 72.84 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 118.722 -0.656 . . . . 0.0 111.939 -176.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.1 pp -67.11 -31.54 72.08 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.377 0.671 . . . . 0.0 111.363 172.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -65.92 -42.65 89.85 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.312 0.96 . . . . 0.0 112.562 -172.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.676 HH21 ' HG ' ' A' ' 66' ' ' LEU . 0.7 OUTLIER -76.72 -20.26 56.75 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 119.766 -1.834 . . . . 0.0 111.879 175.099 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.28 -58.0 7.81 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.777 0.431 . . . . 0.0 110.404 171.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -63.42 -32.35 73.76 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 121.169 -0.957 . . . . 0.0 112.744 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.45 -43.29 94.72 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.924 0.89 . . . . 0.0 112.436 176.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.52 -42.01 87.93 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.54 -0.725 . . . . 0.0 110.883 174.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 18.1 mt -56.77 -42.18 76.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 121.715 -0.615 . . . . 0.0 111.483 172.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -66.9 -19.74 65.78 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.73 -9.03 48.19 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.163 1.385 . . . . 0.0 114.652 171.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -125.42 -37.64 2.35 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -173.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -91.22 143.56 26.53 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.854 1.661 . . . . 0.0 110.236 174.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -64.8 -76.09 0.08 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -155.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -158.12 -58.52 0.02 OUTLIER Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 125.197 1.399 . . . . 0.0 109.812 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.3 -41.09 5.19 Favored 'Trans proline' 0 C--N 1.356 0.925 0 CA-C-N 121.411 1.539 . . . . 0.0 111.241 169.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.06 -41.7 65.08 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 120.765 -1.209 . . . . 0.0 112.536 175.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -60.15 -49.66 76.76 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.566 1.546 . . . . 0.0 110.915 173.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.86 -34.26 70.88 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 125.001 1.286 . . . . 0.0 114.196 175.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.11 -33.38 65.53 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.901 1.35 . . . . 0.0 110.201 175.356 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.73 -43.16 56.44 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.298 -0.876 . . . . 0.0 111.811 -174.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -68.36 -35.74 78.19 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 119.137 -0.458 . . . . 0.0 112.223 174.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.18 -50.21 74.06 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.643 0.656 . . . . 0.0 111.523 172.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.7 mp -56.39 -34.97 67.23 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.268 1.027 . . . . 0.0 112.149 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 3.3 tpt -65.09 -47.01 78.74 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.039 0.836 . . . . 0.0 111.74 177.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -67.06 -42.35 84.91 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.723 -0.611 . . . . 0.0 111.881 176.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -38.93 93.06 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.129 1.372 . . . . 0.0 112.371 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -63.81 -33.75 76.37 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.625 -1.297 . . . . 0.0 112.117 174.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 81.9 mt -77.04 -36.41 24.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.821 1.248 . . . . 0.0 111.589 175.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.599 ' O ' ' OD1' ' A' ' 141' ' ' ASP . 34.0 t0 -68.57 -30.28 69.02 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 120.869 -1.144 . . . . 0.0 110.365 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -96.99 10.03 40.35 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 173.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -68.24 -35.04 77.31 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 120.382 -1.449 . . . . 0.0 113.094 177.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -89.63 127.4 35.9 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.214 1.005 . . . . 0.0 111.945 176.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -77.95 66.93 3.7 Favored 'General case' 0 CA--C 1.548 0.874 0 O-C-N 121.326 -0.859 . . . . 0.0 111.632 173.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 82.5 mt . . . . . 0 CA--C 1.553 1.079 0 C-N-CA 126.258 1.823 . . . . 0.0 115.544 173.304 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 16.8 m80 . . . . . 0 CA--C 1.543 0.706 0 CA-C-O 120.733 0.302 . . . . 0.0 111.33 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 16.6 mt 51.91 72.58 1.16 Allowed Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 126.763 2.025 . . . . 0.0 113.578 -171.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -74.04 -40.38 1.34 Allowed 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 123.586 2.857 . . . . 0.0 113.998 -178.012 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.6 p -76.58 136.87 39.26 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.297 -0.877 . . . . 0.0 112.693 -170.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.1 p -149.17 164.63 34.19 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.656 0.782 . . . . 0.0 112.804 -178.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -92.0 106.83 18.76 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 123.89 0.876 . . . . 0.0 108.996 176.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.63 102.11 3.21 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.625 1.17 . . . . 0.0 109.234 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -153.18 -71.36 0.01 OUTLIER Glycine 0 CA--C 1.526 0.733 0 C-N-CA 123.738 0.685 . . . . 0.0 111.548 -177.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.3 t -153.94 153.1 31.41 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.115 0.966 . . . . 0.0 111.554 177.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 59.0 m -89.16 135.91 33.31 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.41 1.084 . . . . 0.0 111.867 175.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 15.3 m -144.54 159.69 14.78 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.163 0 C-N-CA 125.493 1.517 . . . . 0.0 111.417 175.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -152.27 133.01 14.01 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.285 2.234 . . . . 0.0 107.329 176.227 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.728 ' HA2' ' OD2' ' A' ' 92' ' ' ASP . . . -88.62 122.23 6.29 Favored Glycine 0 C--O 1.218 -0.891 0 O-C-N 121.142 -0.974 . . . . 0.0 113.004 175.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.8 t -76.98 49.61 0.67 Allowed 'General case' 0 C--N 1.318 -0.782 0 O-C-N 120.13 -1.806 . . . . 0.0 112.378 171.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -62.75 153.45 32.75 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.92 0.888 . . . . 0.0 111.652 173.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.8 p -118.4 159.57 23.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.917 0.865 . . . . 0.0 112.272 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.7 t -118.31 124.8 73.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 C-N-CA 126.446 1.898 . . . . 0.0 107.43 -172.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -79.08 -177.22 5.5 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.116 1.366 . . . . 0.0 110.605 176.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.29 -21.26 5.26 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -174.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.33 52.86 1.27 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.242 1.017 . . . . 0.0 112.333 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.75 -120.24 5.18 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 120.674 -1.266 . . . . 0.0 111.722 -170.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 60.18 171.57 0.09 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.505 1.122 . . . . 0.0 113.42 -173.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.35 111.88 23.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.379 -0.826 . . . . 0.0 109.949 172.366 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.5 mt -79.48 153.46 29.59 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 122.964 1.364 . . . . 0.0 112.769 176.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 18.2 mt -57.62 118.69 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.592 1.157 . . . . 0.0 110.338 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.9 p -146.93 130.39 16.75 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.983 0.913 . . . . 0.0 112.068 177.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -69.65 -14.21 62.7 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 120.868 -1.145 . . . . 0.0 113.223 -176.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.728 ' OD2' ' HA2' ' A' ' 77' ' ' GLY . 55.6 t0 -76.33 -15.75 59.9 Favored 'General case' 0 N--CA 1.455 -0.197 0 O-C-N 121.14 -0.975 . . . . 0.0 111.985 -177.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.3 -39.51 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.513 0.725 . . . . 0.0 112.4 174.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -64.14 -40.53 96.37 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 120.752 -1.217 . . . . 0.0 112.444 178.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -67.33 -30.4 70.21 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.372 1.069 . . . . 0.0 111.516 178.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -51.93 67.92 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.247 1.019 . . . . 0.0 111.605 172.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -67.34 -39.92 85.82 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.743 -0.646 . . . . 0.0 111.241 179.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.58 -45.46 93.88 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.13 0.972 . . . . 0.0 112.795 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.34 69.29 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -99.62 -14.84 18.8 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.966 0.906 . . . . 0.0 112.702 174.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.4 mt -70.98 -43.86 67.18 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.454 1.102 . . . . 0.0 112.442 171.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.1 t -68.72 -12.61 61.64 Favored 'General case' 0 N--CA 1.485 1.297 0 CA-C-N 120.553 1.524 . . . . 0.0 112.081 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -87.28 25.55 1.37 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.789 1.636 . . . . 0.0 113.871 171.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.8 p -104.84 -17.7 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -178.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -81.2 -51.83 4.53 Favored Glycine 0 N--CA 1.475 1.284 0 O-C-N 121.391 -0.818 . . . . 0.0 113.368 -169.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -82.31 161.08 22.73 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.744 1.218 . . . . 0.0 111.019 168.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 1.285 ' OE1' ' N ' ' A' ' 107' ' ' GLU . 0.0 OUTLIER 61.46 161.16 0.11 Allowed Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 126.672 1.989 . . . . 0.0 113.94 -178.098 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.4 ' HD2' ' HB3' ' A' ' 107' ' ' GLU . 51.3 Cg_endo -63.76 127.44 19.65 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 121.618 1.546 . . . . 0.0 110.483 174.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.7 tt -52.52 -34.92 51.96 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.313 1.045 . . . . 0.0 112.371 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -37.97 25.55 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.518 1.127 . . . . 0.0 113.029 173.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -74.99 -29.54 60.92 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 44.8 t -62.98 -52.38 63.2 Favored 'General case' 0 N--CA 1.484 1.233 0 O-C-N 121.091 -1.006 . . . . 0.0 109.653 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.41 -32.37 73.71 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-O 117.545 -1.217 . . . . 0.0 113.401 177.722 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.46 -56.83 14.79 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.247 1.419 . . . . 0.0 109.596 178.322 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -67.82 -30.48 69.89 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 173.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.55 -63.92 1.04 Allowed 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.572 1.149 . . . . 0.0 111.751 -174.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -23.79 62.02 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 117.819 -1.086 . . . . 0.0 113.605 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.98 -50.33 66.78 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.519 0.728 . . . . 0.0 111.742 170.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.93 -47.7 84.1 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.895 0.771 . . . . 0.0 111.459 172.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 60.9 mt -56.32 -44.85 80.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.987 0.812 . . . . 0.0 110.836 179.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -76.19 -18.35 59.11 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -86.46 -6.26 58.95 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 173.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.529 ' OE2' ' HA ' ' A' ' 123' ' ' GLU . 27.9 mm-40 -128.49 -37.33 1.81 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -174.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.5 mp -80.69 162.14 24.29 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.137 0.494 . . . . 0.0 110.378 166.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -82.9 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.188 0 CA-C-O 121.921 0.867 . . . . 0.0 113.195 -174.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -164.98 -61.41 0.01 OUTLIER Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.443 1.497 . . . . 0.0 109.528 -178.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.1 -42.95 26.58 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.286 1.324 . . . . 0.0 110.906 173.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.5 -40.74 75.48 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.273 1.029 . . . . 0.0 112.724 177.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -60.76 -41.7 96.0 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.235 1.014 . . . . 0.0 110.568 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -56.58 -39.9 86.31 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 124.421 1.01 . . . . 0.0 113.909 174.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -72.03 -38.44 69.56 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.08 0.94 . . . . 0.0 112.972 171.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.62 -50.17 73.66 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 121.352 1.887 . . . . 0.0 112.578 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.1 pp -66.58 -33.57 75.96 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 176.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.39 -50.81 70.04 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.341 -0.849 . . . . 0.0 112.02 171.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 83.2 mt -58.45 -30.78 67.21 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.441 1.019 . . . . 0.0 111.726 176.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 7.6 ttp -63.62 -64.34 0.92 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.225 1.41 . . . . 0.0 111.963 172.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -64.14 -29.32 70.45 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.872 -1.142 . . . . 0.0 112.44 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.84 -46.62 87.07 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.457 1.903 . . . . 0.0 113.269 171.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.541 ' C ' ' CD1' ' A' ' 139' ' ' TYR . 0.5 OUTLIER -75.88 -22.28 56.32 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 118.145 -1.422 . . . . 0.0 109.873 -177.367 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 69.1 mt -71.58 -45.13 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.023 171.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -58.55 -45.23 89.37 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.482 1.513 . . . . 0.0 110.395 175.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -93.67 15.65 15.78 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.291 1.037 . . . . 0.0 113.588 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -64.34 -39.67 94.35 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 120.271 -1.518 . . . . 0.0 111.476 -178.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 10.3 mmpt? -74.43 118.77 17.77 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -69.37 70.28 0.26 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.418 1.087 . . . . 0.0 112.392 172.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 31.6 mt . . . . . 0 CA--C 1.55 0.951 0 C-N-CA 124.846 1.258 . . . . 0.0 112.358 171.813 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 65.9 m170 . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 93.0 mt -129.77 48.91 4.08 Favored Pre-proline 0 CA--C 1.552 1.029 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 -173.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -63.96 -24.39 67.34 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 123.456 2.771 . . . . 0.0 114.099 -175.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.1 t -93.61 6.42 48.33 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.797 1.639 . . . . 0.0 113.615 -178.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 75.0 p -66.0 154.5 39.26 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.716 -1.24 . . . . 0.0 114.151 -178.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -70.58 45.41 0.08 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.572 1.949 . . . . 0.0 115.029 -177.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 10.6 ptt180 -57.21 -28.92 63.29 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 -173.045 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 64.1 -100.27 0.39 Allowed Glycine 0 CA--C 1.532 1.149 0 C-N-CA 123.637 0.637 . . . . 0.0 113.805 171.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 64.6 p -83.17 -161.57 0.52 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.09 2.156 . . . . 0.0 111.514 -178.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.8 p -86.86 94.46 9.57 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 120.228 -1.545 . . . . 0.0 111.404 165.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.9 m -64.3 144.91 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 125.05 1.34 . . . . 0.0 110.449 164.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -93.52 -51.09 5.11 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -163.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 55.98 22.17 33.9 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.951 1.263 . . . . 0.0 116.235 170.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.71 32.35 3.42 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.076 1.438 . . . . 0.0 111.59 -174.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -56.27 148.74 17.79 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.299 1.04 . . . . 0.0 112.524 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.6 p -125.32 161.2 27.52 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.716 1.246 . . . . 0.0 113.476 -170.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.5 m -138.46 149.11 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 126.103 1.761 . . . . 0.0 109.838 -175.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -79.5 177.98 8.46 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 124.354 1.061 . . . . 0.0 111.843 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.19 13.1 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 128.32 2.648 . . . . 0.0 116.767 -177.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.8 m -156.92 30.43 0.31 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.661 1.984 . . . . 0.0 111.355 169.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.1 -127.48 8.69 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 120.557 -1.339 . . . . 0.0 112.219 -173.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 57.09 -170.34 0.1 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.426 1.09 . . . . 0.0 112.282 -167.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.35 116.53 26.39 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.438 -0.789 . . . . 0.0 109.823 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mt -88.64 158.02 18.37 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 123.032 1.396 . . . . 0.0 112.884 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 14.2 mt -80.2 95.11 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 124.462 1.105 . . . . 0.0 110.065 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . 0.256 8.1 t -119.45 3.92 11.22 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.006 1.323 . . . . 0.0 113.731 174.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 15.2 ttm105 65.94 -17.75 0.11 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 126.19 1.796 . . . . 0.0 115.42 -177.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -43.01 -47.02 5.71 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.862 1.665 . . . . 0.0 114.814 176.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 48.9 pt -57.18 -27.72 28.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -176.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -70.2 -48.78 55.64 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.158 0.89 . . . . 0.0 110.977 175.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -60.66 -34.4 74.26 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.38 0.672 . . . . 0.0 111.382 173.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 tt -64.09 -49.21 73.16 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.256 1.022 . . . . 0.0 111.864 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -62.8 -44.28 96.58 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.231 0.923 . . . . 0.0 112.711 171.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.11 -42.03 76.18 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.685 1.13 . . . . 0.0 112.308 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.28 -46.25 91.1 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.455 -0.778 . . . . 0.0 112.367 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -78.63 -21.38 48.51 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.7 mt -73.02 -48.33 37.19 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 118.731 0.696 . . . . 0.0 112.145 170.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 13.5 t -83.99 -8.16 59.22 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -174.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -127.34 30.99 5.29 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.315 1.446 . . . . 0.0 113.12 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 9.0 p -66.83 -38.21 81.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -171.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 72.14 -2.68 25.96 Favored Glycine 0 CA--C 1.544 1.876 0 N-CA-C 116.632 1.413 . . . . 0.0 116.632 -177.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -146.51 141.02 26.62 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.825 1.65 . . . . 0.0 110.954 -177.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -66.39 -53.39 31.02 Favored Pre-proline 0 N--CA 1.476 0.835 0 C-N-CA 123.643 0.777 . . . . 0.0 112.808 172.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.447 ' C ' ' H ' ' A' ' 110' ' ' GLN . 91.7 Cg_endo -72.77 95.17 0.8 Allowed 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 121.878 1.719 . . . . 0.0 108.435 168.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.28 9.98 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 128.748 2.819 . . . . 0.0 115.892 -177.391 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.447 ' H ' ' C ' ' A' ' 108' ' ' PRO . 0.3 OUTLIER -62.1 -47.01 86.55 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 129.087 2.955 . . . . 0.0 113.937 -169.954 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -83.27 -27.3 29.95 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.568 1.077 . . . . 0.0 112.381 -176.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 33.9 t -61.97 -48.83 78.6 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 124.716 1.207 . . . . 0.0 110.154 168.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.49 -38.84 88.13 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 118.149 -0.929 . . . . 0.0 112.15 178.251 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -54.54 -47.12 73.56 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.243 1.417 . . . . 0.0 111.544 179.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.84 -43.01 63.16 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.887 1.275 . . . . 0.0 111.907 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 52.4 tp -57.11 -53.36 58.96 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.459 1.104 . . . . 0.0 111.94 178.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -62.88 -30.13 71.29 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.504 -0.748 . . . . 0.0 112.567 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.94 -40.46 63.06 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.211 1.004 . . . . 0.0 111.617 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.0 -39.39 79.36 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.387 0.675 . . . . 0.0 111.066 175.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 17.0 mt -61.62 -43.32 96.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 O-C-N 121.302 -0.874 . . . . 0.0 111.175 172.284 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.65 -25.17 63.79 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -80.91 -36.87 30.57 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 174.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -93.98 -34.35 13.09 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -175.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 27.5 mt -81.28 170.95 15.43 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.448 1.022 . . . . 0.0 112.41 173.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.96 -78.18 0.2 Allowed 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.693 -0.63 . . . . 0.0 112.101 -167.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -162.05 -63.37 0.02 OUTLIER Pre-proline 0 CA--C 1.543 0.683 0 C-N-CA 125.581 1.553 . . . . 0.0 109.291 174.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -64.52 -37.19 39.39 Favored 'Trans proline' 0 C--N 1.356 0.922 0 CA-C-N 121.156 1.449 . . . . 0.0 111.126 174.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.27 -41.18 62.64 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.403 1.081 . . . . 0.0 112.889 172.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 8.6 ttt180 -63.39 -49.18 74.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.372 1.069 . . . . 0.0 110.587 175.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.71 -31.77 72.3 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.564 1.078 . . . . 0.0 113.894 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -77.22 -32.97 56.25 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.511 1.155 . . . . 0.0 110.95 173.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.22 -46.59 60.85 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.483 -0.761 . . . . 0.0 110.958 -175.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -66.31 -37.96 86.61 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.133 0.573 . . . . 0.0 112.45 174.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.24 -53.58 55.02 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.85 0.75 . . . . 0.0 111.711 176.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 93.0 mt -59.66 -32.51 70.54 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 118.364 -0.827 . . . . 0.0 111.405 177.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 45.9 ttp -66.66 -51.63 53.95 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.558 0.743 . . . . 0.0 112.652 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -65.68 -40.16 92.06 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.302 -0.874 . . . . 0.0 111.763 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -44.4 97.06 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.605 1.162 . . . . 0.0 111.475 174.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -60.18 -47.08 87.46 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.646 -0.659 . . . . 0.0 111.317 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 65.1 mt -59.98 -39.68 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.623 0.769 . . . . 0.0 111.198 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -61.66 -43.23 99.26 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -92.09 6.57 46.0 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -79.11 -20.23 49.18 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.262 1.425 . . . . 0.0 112.743 174.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.2 ptpp? -82.39 138.84 34.35 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.438 0.695 . . . . 0.0 111.211 169.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -80.32 49.41 1.13 Allowed 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 176.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 39.8 mt . . . . . 0 N--CA 1.478 0.937 0 C-N-CA 126.41 1.884 . . . . 0.0 115.148 179.868 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 CA--C 1.548 0.9 0 CA-C-O 121.958 0.885 . . . . 0.0 112.081 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -59.19 161.88 4.98 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.606 1.963 . . . . 0.0 112.369 172.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.9 p -114.27 165.66 12.45 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.3 1.048 . . . . 0.0 113.648 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.2 p -128.83 130.84 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 126.931 2.093 . . . . 0.0 109.961 -172.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -77.99 173.7 11.9 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.519 1.128 . . . . 0.0 111.477 174.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.01 3.96 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 127.617 2.367 . . . . 0.0 116.403 -173.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 15.2 m -152.55 30.41 0.53 Allowed 'General case' 0 N--CA 1.471 0.591 0 O-C-N 119.896 -1.753 . . . . 0.0 112.517 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 92.09 -128.17 9.26 Favored Glycine 0 CA--C 1.528 0.901 0 O-C-N 120.631 -1.293 . . . . 0.0 110.51 -167.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 57.08 172.74 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.821 1.248 . . . . 0.0 112.989 -169.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.3 122.16 43.19 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 120.977 -1.077 . . . . 0.0 109.321 172.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.7 mt -88.37 143.89 26.73 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 120.223 1.374 . . . . 0.0 111.622 173.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.5 mt -63.4 109.82 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.931 1.292 . . . . 0.0 110.037 -176.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 p -149.37 143.29 25.67 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.302 1.441 . . . . 0.0 110.847 -173.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 32.5 ttt-85 -71.65 -13.57 61.79 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -175.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -51.98 -40.47 60.99 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.699 1.2 . . . . 0.0 112.294 171.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 67.1 mt -54.55 -33.95 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.158 0.983 . . . . 0.0 111.572 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 40.1 ttt85 -83.38 -32.4 26.22 Favored 'General case' 0 N--CA 1.456 -0.144 0 O-C-N 120.941 -1.099 . . . . 0.0 111.686 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -61.98 -35.06 77.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.472 -0.142 . . . . 0.0 111.189 170.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.4 -52.84 56.17 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.144 1.378 . . . . 0.0 111.641 177.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -61.74 -46.0 91.53 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.652 -0.655 . . . . 0.0 112.322 172.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -59.77 -41.42 91.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.305 0.957 . . . . 0.0 112.346 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.92 -43.66 98.39 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.695 -0.628 . . . . 0.0 111.608 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -85.66 -12.88 50.19 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.4 mt -73.22 -40.05 65.01 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.635 1.107 . . . . 0.0 111.97 170.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.9 m . . . . . 0 N--CA 1.472 0.655 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 171.089 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.4 t0 . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 120.843 0.354 . . . . 0.0 111.269 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -70.09 -43.85 70.24 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.207 -0.933 . . . . 0.0 111.929 169.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 54.5 tp -51.13 -61.62 2.12 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.677 0.791 . . . . 0.0 111.44 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.8 ppt_? -60.13 -28.24 67.72 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.847 0.859 . . . . 0.0 112.763 -178.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.76 -41.82 74.67 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 173.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -59.79 -47.84 84.08 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.096 0.862 . . . . 0.0 112.163 176.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.1 mp -60.1 -42.66 90.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 118.517 0.599 . . . . 0.0 111.088 176.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.54 -23.49 65.44 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.42 -50.55 5.89 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.71 0.804 . . . . 0.0 112.735 174.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -76.94 -38.48 53.27 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.416 -1.427 . . . . 0.0 113.206 -170.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.475 HD12 ' HB1' ' A' ' 128' ' ' ALA . 3.3 mm? -68.66 -172.33 0.35 Allowed 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 120.199 1.363 . . . . 0.0 111.567 171.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -97.5 -120.34 0.13 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.632 1.173 . . . . 0.0 110.109 169.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.484 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 20.5 tt0 -120.26 -63.86 0.03 OUTLIER Pre-proline 0 CA--C 1.536 0.423 0 C-N-CA 125.699 1.6 . . . . 0.0 108.448 -172.449 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.484 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.9 Cg_endo -67.22 -36.3 21.76 Favored 'Trans proline' 0 C--N 1.351 0.675 0 CA-C-N 120.641 1.265 . . . . 0.0 111.307 174.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.475 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -59.74 -34.25 72.71 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 120.833 -1.167 . . . . 0.0 112.477 176.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 19.0 ttt180 -63.09 -48.77 77.17 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.279 1.031 . . . . 0.0 110.434 172.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.14 -34.57 80.21 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 124.729 1.157 . . . . 0.0 113.514 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -75.25 -33.04 61.26 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 118.38 1.09 . . . . 0.0 111.171 174.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.03 -44.93 62.61 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.212 0.605 . . . . 0.0 111.132 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.35 -37.05 80.12 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.252 0.621 . . . . 0.0 112.365 174.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.22 -55.49 24.54 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 118.387 0.54 . . . . 0.0 111.696 175.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.8 mp -56.9 -30.47 63.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.2 175.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 9.3 tmm? -67.34 -52.05 44.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.215 0.916 . . . . 0.0 111.673 176.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -67.37 -38.33 84.6 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.45 -0.781 . . . . 0.0 112.583 177.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.11 -34.96 73.77 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.529 1.532 . . . . 0.0 112.224 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -63.13 -46.94 84.9 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.115 -0.99 . . . . 0.0 110.3 168.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 78.2 mt -60.58 -34.94 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.588 0.755 . . . . 0.0 112.269 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.468 ' O ' ' OD1' ' A' ' 141' ' ' ASP . 48.4 t0 -67.37 -25.3 65.9 Favored 'General case' 0 C--N 1.34 0.177 0 C-N-CA 124.101 0.96 . . . . 0.0 111.63 -177.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -113.21 5.81 17.16 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? . . . . . 0 N--CA 1.479 1.022 0 O-C-N 120.675 -1.265 . . . . 0.0 112.94 -177.957 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 CA--C 1.545 0.781 0 CA-C-O 123.563 1.649 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -68.8 165.75 19.04 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.44 -1.413 . . . . 0.0 111.043 165.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.5 p -134.43 160.33 38.33 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.729 0.776 . . . . 0.0 112.335 175.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.4 t -122.76 128.13 75.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 125.927 1.691 . . . . 0.0 108.193 -169.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -81.84 177.1 9.07 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.561 1.144 . . . . 0.0 112.726 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.93 -19.15 1.63 Allowed 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -170.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.5 m -134.69 29.93 3.48 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.039 1.336 . . . . 0.0 112.434 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 96.21 -123.12 7.59 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -171.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 50.1 m-20 59.22 178.62 0.08 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.66 1.184 . . . . 0.0 114.067 -176.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.12 127.37 54.11 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.369 -0.832 . . . . 0.0 109.114 168.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.8 mt -93.22 149.75 21.0 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 122.117 0.961 . . . . 0.0 110.957 168.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 16.7 mt -79.75 99.74 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 O-C-N 121.447 -0.783 . . . . 0.0 110.625 -173.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 30.1 p -118.28 -1.48 11.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.254 1.022 . . . . 0.0 113.398 170.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 64.95 -0.31 1.05 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.152 1.781 . . . . 0.0 115.389 -175.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -50.06 -49.5 51.05 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.843 1.657 . . . . 0.0 114.718 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.2 pt -52.6 -25.86 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 N-CA-C 113.72 1.008 . . . . 0.0 113.72 -176.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -61.66 -45.59 93.36 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.672 1.124 . . . . 0.0 112.145 171.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -58.29 -40.71 82.67 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.054 0.843 . . . . 0.0 111.637 173.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.47 -39.65 85.29 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.554 0.742 . . . . 0.0 111.983 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -70.88 -43.63 67.99 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.092 0.86 . . . . 0.0 112.603 171.05 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -59.14 -36.84 75.96 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.4 1.08 . . . . 0.0 112.234 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.89 -24.17 67.45 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 175.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -111.04 -11.78 14.26 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.429 1.092 . . . . 0.0 113.641 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.4 mt -75.93 -33.82 59.87 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.302 1.041 . . . . 0.0 111.008 167.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.4 p . . . . . 0 CA--C 1.538 0.486 0 C-N-CA 124.553 1.141 . . . . 0.0 112.13 170.836 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.477 0.887 0 CA-C-O 121.4 0.619 . . . . 0.0 110.939 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 85.2 mtm180 -65.37 -46.62 79.42 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.475 1.11 . . . . 0.0 111.007 176.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.1 tt -51.05 -64.01 0.95 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.626 1.17 . . . . 0.0 111.4 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -32.48 68.54 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.561 1.144 . . . . 0.0 112.809 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.87 87.38 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.904 -0.569 . . . . 0.0 112.127 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -60.79 -47.85 84.45 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.781 0.719 . . . . 0.0 112.116 176.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.3 mp -63.15 -45.03 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.155 0.889 . . . . 0.0 111.348 176.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.79 -29.74 69.01 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -179.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.67 -65.83 0.74 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.812 0.845 . . . . 0.0 110.899 172.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -70.72 -46.08 63.73 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.304 1.441 . . . . 0.0 113.403 -169.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 6.8 mp -78.58 164.13 24.93 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 120.727 -1.233 . . . . 0.0 109.809 168.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -79.09 -93.47 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.499 0.72 . . . . 0.0 112.329 -165.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.465 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 47.0 tt0 -146.92 -54.6 0.02 OUTLIER Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 124.962 1.305 . . . . 0.0 111.198 175.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.465 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 64.2 Cg_endo -70.84 -38.89 4.91 Favored 'Trans proline' 0 C--N 1.354 0.84 0 CA-C-N 121.449 1.553 . . . . 0.0 111.004 171.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.69 -42.08 64.46 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.221 1.408 . . . . 0.0 112.678 177.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -56.36 -49.29 74.82 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.766 2.026 . . . . 0.0 111.19 173.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.22 -34.38 67.13 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 125.151 1.357 . . . . 0.0 113.798 176.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -76.79 -31.19 56.83 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.457 1.128 . . . . 0.0 110.92 175.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.2 -50.98 50.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 122.87 0.468 . . . . 0.0 110.36 -178.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.7 pp -66.34 -35.77 81.21 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 177.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.65 -53.11 56.51 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.603 0.638 . . . . 0.0 112.019 174.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.67 -27.57 68.78 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 117.655 -1.164 . . . . 0.0 111.692 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -64.93 -53.09 51.86 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.866 1.212 . . . . 0.0 111.677 173.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -64.31 -41.45 96.84 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 177.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -68.41 -40.39 81.28 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.011 1.324 . . . . 0.0 112.671 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -58.19 -38.51 76.87 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.201 -0.937 . . . . 0.0 111.157 169.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 86.4 mt -71.23 -44.43 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 123.712 0.805 . . . . 0.0 112.387 177.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -54.44 -31.43 55.39 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.608 1.563 . . . . 0.0 111.466 174.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -106.34 3.93 28.06 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 178.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt . . . . . 0 N--CA 1.485 1.279 0 C-N-CA 125.022 1.329 . . . . 0.0 112.875 179.018 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 C--O 1.238 0.487 0 CA-C-O 121.151 0.501 . . . . 0.0 109.701 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -53.48 154.96 3.18 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.435 1.112 . . . . 0.0 111.711 175.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 5.9 p -114.2 157.88 22.09 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.204 1.402 . . . . 0.0 111.722 -175.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.5 t -129.48 128.23 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 125.505 1.522 . . . . 0.0 107.478 -172.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -81.54 -175.17 5.38 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.736 0.814 . . . . 0.0 111.293 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.39 -21.0 8.44 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -172.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -144.73 50.79 1.26 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.291 1.036 . . . . 0.0 112.334 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.07 -122.82 5.84 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 120.376 -1.452 . . . . 0.0 110.826 -169.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 m120 60.31 172.0 0.09 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.338 1.055 . . . . 0.0 112.964 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.59 119.14 38.65 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 170.29 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.62 143.52 38.17 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-O 121.568 0.699 . . . . 0.0 110.12 173.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 48.0 mm -73.23 108.33 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 O-C-N 121.56 -0.712 . . . . 0.0 109.932 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.2 p -152.32 158.24 42.47 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.991 1.316 . . . . 0.0 112.392 177.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -57.93 -14.23 5.9 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.488 1.515 . . . . 0.0 114.494 -174.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -66.15 -28.79 69.06 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 122.47 0.308 . . . . 0.0 111.7 -178.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.542 HG21 HD23 ' A' ' 135' ' ' LEU . 88.1 mt -62.51 -53.99 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 121.285 0.564 . . . . 0.0 111.662 178.312 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -72.28 -28.75 63.31 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 118.587 -0.72 . . . . 0.0 112.818 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -70.48 -40.11 73.81 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.75 174.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.07 -51.25 58.78 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.819 1.247 . . . . 0.0 111.606 170.224 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -66.0 -36.12 82.42 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.034 -1.041 . . . . 0.0 112.056 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.57 -48.13 80.81 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.982 1.264 . . . . 0.0 111.306 173.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.44 -35.32 75.54 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.99 0.916 . . . . 0.0 112.644 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -91.04 -17.09 26.83 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.9 mt -72.98 -34.95 66.77 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 120.605 -1.31 . . . . 0.0 113.019 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 CA--C 1.545 0.781 0 CA-C-N 119.339 0.972 . . . . 0.0 113.096 175.045 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.2 t70 . . . . . 0 N--CA 1.472 0.649 0 N-CA-C 110.524 -0.176 . . . . 0.0 110.524 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -78.03 -41.29 36.17 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.767 0.827 . . . . 0.0 111.167 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 33.2 tp -55.99 -59.77 4.43 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.966 0.412 . . . . 0.0 111.994 177.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -24.83 64.44 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.349 -0.834 . . . . 0.0 113.002 -178.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.48 -51.27 53.34 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.864 0.756 . . . . 0.0 111.842 170.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -51.06 69.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.551 0.74 . . . . 0.0 110.812 173.372 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 62.1 mt -55.45 -43.7 73.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 O-C-N 121.7 -0.625 . . . . 0.0 111.461 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -77.8 -24.66 48.75 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -75.73 -42.54 50.41 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.606 0.763 . . . . 0.0 110.056 172.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -76.74 -61.13 2.07 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 124.598 1.159 . . . . 0.0 112.9 -178.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 57.5 mt -60.38 171.9 0.97 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.926 1.239 . . . . 0.0 112.221 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 10.8 tp-100 -71.48 -88.99 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.857 0.863 . . . . 0.0 111.936 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -166.13 -59.19 0.01 OUTLIER Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 125.645 1.578 . . . . 0.0 109.432 -172.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -63.2 -44.49 15.04 Favored 'Trans proline' 0 C--N 1.359 1.104 0 CA-C-N 120.357 1.163 . . . . 0.0 110.748 171.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.27 -37.54 75.17 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.435 1.094 . . . . 0.0 112.772 177.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 14.1 ttt180 -58.24 -47.24 84.15 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.484 0.714 . . . . 0.0 110.671 174.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -54.08 -45.47 72.45 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.299 0.952 . . . . 0.0 112.793 176.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.08 -37.19 83.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.01 0.905 . . . . 0.0 113.16 174.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.42 -50.01 61.26 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 120.627 1.558 . . . . 0.0 112.324 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.0 pp -65.45 -34.82 79.19 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.732 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.35 -48.38 75.75 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-O 119.054 -0.498 . . . . 0.0 111.301 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.542 HD23 HG21 ' A' ' 93' ' ' ILE . 6.0 mp -61.01 -28.07 68.77 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.349 -1.31 . . . . 0.0 111.471 175.137 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.39 -58.47 6.97 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 120.154 1.343 . . . . 0.0 111.851 172.441 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -66.75 -37.14 84.05 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.276 -0.89 . . . . 0.0 112.48 178.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.21 -45.02 90.1 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.154 1.382 . . . . 0.0 112.102 174.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -59.3 -42.26 90.93 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 118.876 -0.583 . . . . 0.0 110.609 171.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.99 -33.61 59.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-O 118.091 -0.957 . . . . 0.0 112.17 175.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -62.87 -44.04 97.18 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.398 0.999 . . . . 0.0 112.466 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -100.21 14.2 31.65 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 174.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 23.2 ttpt . . . . . 0 N--CA 1.483 1.189 0 O-C-N 120.639 -1.288 . . . . 0.0 112.865 -175.922 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 CA--C 1.546 0.82 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -62.07 154.31 27.29 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.824 1.25 . . . . 0.0 114.262 -168.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.563 ' H ' HG21 ' A' ' 90' ' ' THR . 35.8 p -92.24 152.92 19.59 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.067 1.347 . . . . 0.0 112.956 177.315 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.3 t -122.89 137.27 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 126.052 1.741 . . . . 0.0 107.926 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -75.8 175.64 8.53 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.428 1.091 . . . . 0.0 111.794 176.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.7 -12.38 1.83 Allowed 'General case' 0 CA--C 1.553 1.09 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 -174.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.8 m -155.63 64.53 0.6 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.773 1.629 . . . . 0.0 110.536 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 73.6 -123.96 8.48 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 121.709 -0.619 . . . . 0.0 111.97 -174.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.406 ' O ' ' HB2' ' A' ' 128' ' ' ALA . 5.4 m120 55.31 -179.51 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.864 1.265 . . . . 0.0 112.733 -172.331 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -115.3 127.23 55.31 Favored 'General case' 0 N--CA 1.481 1.116 0 O-C-N 120.291 -1.506 . . . . 0.0 110.747 171.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.8 mt -96.23 154.66 17.13 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 122.709 1.243 . . . . 0.0 112.863 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 32.6 mm -78.48 93.57 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 124.555 1.142 . . . . 0.0 111.235 -175.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.563 HG21 ' H ' ' A' ' 80' ' ' SER 0.255 13.7 t -132.15 12.96 4.69 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -179.29 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 66.82 -19.27 0.11 Allowed 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 116.671 2.1 . . . . 0.0 116.671 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -42.62 -51.22 5.27 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 126.385 1.874 . . . . 0.0 114.828 178.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 21.6 pt -55.51 -31.29 27.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 94' ' ' ARG . 2.7 mtp85 -67.02 -43.77 81.98 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.164 -0.96 . . . . 0.0 111.527 175.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -69.51 -19.67 63.72 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.699 1.6 . . . . 0.0 112.919 176.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.86 -56.94 4.15 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.087 1.355 . . . . 0.0 111.246 167.134 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -59.82 -41.5 91.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.095 0.861 . . . . 0.0 112.89 -178.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -64.96 -37.68 88.46 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.875 0.761 . . . . 0.0 111.953 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.08 -30.44 70.35 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.415 0.895 . . . . 0.0 113.415 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -89.12 -38.23 14.48 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.793 0.837 . . . . 0.0 113.043 173.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.2 mt -59.02 -45.25 91.16 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.342 0.974 . . . . 0.0 111.041 176.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.3 m . . . . . 0 CA--C 1.546 0.812 0 C-N-CA 125.105 1.362 . . . . 0.0 114.307 177.697 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.468 0.45 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 70.1 mtt-85 -70.03 -44.94 68.22 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.665 -0.647 . . . . 0.0 111.81 171.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.2 tt -50.08 -61.55 2.09 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.231 1.013 . . . . 0.0 111.533 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.97 -27.51 68.33 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.514 -1.366 . . . . 0.0 113.387 179.16 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.69 -43.5 68.9 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 124.127 0.892 . . . . 0.0 111.566 177.082 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -53.98 -52.39 60.87 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.641 0.776 . . . . 0.0 111.545 176.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.18 -42.71 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 O-C-N 121.371 -0.831 . . . . 0.0 111.922 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.41 ' HB2' ' CZ ' ' A' ' 129' ' ' ARG . . . -70.28 -31.03 68.21 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.029 -1.045 . . . . 0.0 113.596 -178.386 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.08 -63.97 0.95 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.417 0.687 . . . . 0.0 110.483 169.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -62.06 -50.44 71.96 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.19 2.196 . . . . 0.0 113.929 -171.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.441 HD12 ' HB1' ' A' ' 128' ' ' ALA . 2.6 mm? -78.59 164.47 24.64 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 122.276 1.036 . . . . 0.0 110.328 176.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -77.2 -94.13 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.183 0.993 . . . . 0.0 111.447 -169.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.519 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 37.6 tt0 -140.79 -58.68 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 124.646 1.178 . . . . 0.0 110.454 167.116 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.519 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.2 Cg_endo -66.88 -35.75 25.68 Favored 'Trans proline' 0 C--N 1.352 0.739 0 CA-C-N 122.036 1.763 . . . . 0.0 111.484 176.047 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.441 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -57.98 -32.01 67.46 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 120.98 -1.075 . . . . 0.0 112.779 173.132 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.41 ' CZ ' ' HB2' ' A' ' 121' ' ' ALA . 0.0 OUTLIER -64.14 -48.77 74.73 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.063 1.345 . . . . 0.0 109.903 173.499 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.19 -34.32 87.63 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 126.415 1.959 . . . . 0.0 114.49 176.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -74.98 -30.71 61.26 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.777 1.288 . . . . 0.0 110.475 173.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.86 58.42 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 122.909 0.484 . . . . 0.0 110.357 -176.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -66.51 -39.76 88.85 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 118.914 -0.565 . . . . 0.0 111.841 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.42 -54.54 44.3 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.37 0.986 . . . . 0.0 111.913 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 9.2 mp -64.45 -25.96 68.23 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.698 176.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 59.7 ttp -65.78 -53.02 45.96 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 120.056 1.298 . . . . 0.0 111.831 172.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -66.92 -43.15 84.03 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.122 0.874 . . . . 0.0 111.619 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -28.16 68.29 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.412 1.085 . . . . 0.0 112.846 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -68.0 -47.74 67.68 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.468 -1.395 . . . . 0.0 111.186 167.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 85.8 mt -62.27 -38.58 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.387 1.075 . . . . 0.0 112.561 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -52.98 -32.92 48.85 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.215 1.806 . . . . 0.0 113.09 173.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -112.85 2.69 16.02 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.405 1.482 . . . . 0.0 114.02 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? . . . . . 0 N--CA 1.48 1.045 0 C-N-CA 125.932 1.693 . . . . 0.0 112.681 175.814 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.467 0.404 0 CA-C-O 120.972 0.415 . . . . 0.0 110.0 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -78.1 178.98 7.12 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 128.041 2.536 . . . . 0.0 113.157 -174.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 32.5 p -115.35 161.67 18.19 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.771 1.229 . . . . 0.0 113.921 176.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.1 t -135.7 133.42 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 126.174 1.79 . . . . 0.0 109.541 -171.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -88.98 178.25 6.45 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.722 1.209 . . . . 0.0 112.961 177.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.53 -1.64 0.16 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 127.928 2.491 . . . . 0.0 117.718 -167.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 31.0 t -152.56 35.94 0.51 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.398 1.479 . . . . 0.0 111.372 173.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 87.47 -123.15 6.48 Favored Glycine 0 CA--C 1.529 0.912 0 O-C-N 120.934 -1.104 . . . . 0.0 110.649 -167.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 59.39 175.92 0.08 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.951 0.9 . . . . 0.0 111.665 -163.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.9 132.48 52.8 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 117.788 -1.101 . . . . 0.0 108.901 165.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.3 mt -98.69 150.51 21.72 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.916 1.235 . . . . 0.0 112.316 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 24.5 mt -63.62 111.81 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 125.144 1.378 . . . . 0.0 110.628 -173.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -142.74 154.38 44.22 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.76 1.224 . . . . 0.0 112.291 -173.508 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -101.03 -10.54 20.43 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -164.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -64.69 -29.48 70.47 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.892 0.877 . . . . 0.0 111.66 168.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 64.5 mt -49.77 -40.38 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 125.778 1.631 . . . . 0.0 112.103 175.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.18 -53.19 58.84 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 121.417 -0.802 . . . . 0.0 110.978 173.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -61.45 -30.0 70.31 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.823 0.849 . . . . 0.0 111.997 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.88 -53.52 52.84 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.984 1.714 . . . . 0.0 111.746 173.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -60.94 -43.55 98.51 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.32 -0.848 . . . . 0.0 112.416 173.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.47 -40.65 87.64 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.179 1.354 . . . . 0.0 112.636 177.52 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.88 -20.78 66.61 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -112.39 -21.74 11.22 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.365 1.066 . . . . 0.0 113.656 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.12 -48.94 74.12 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 118.998 0.817 . . . . 0.0 110.079 169.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 CA--C 1.54 0.563 0 C-N-CA 123.809 0.843 . . . . 0.0 113.137 179.231 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 55.4 t0 . . . . . 0 N--CA 1.474 0.775 0 CA-C-O 120.789 0.328 . . . . 0.0 110.809 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.4 mtt85 -59.97 -40.61 89.69 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.071 -1.018 . . . . 0.0 112.263 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 50.5 tp -62.12 -57.35 11.88 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.795 0.838 . . . . 0.0 112.496 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.6 ptm85 -60.91 -33.8 73.7 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.677 -0.639 . . . . 0.0 111.589 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.66 -44.02 87.58 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 124.198 0.936 . . . . 0.0 111.421 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.74 -42.7 81.42 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.477 0.711 . . . . 0.0 110.741 176.091 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 18.0 mt -61.09 -42.44 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.259 -0.901 . . . . 0.0 111.208 176.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.38 -22.2 61.91 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -84.64 -31.62 24.1 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 171.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -99.73 -34.77 10.04 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 115.324 1.601 . . . . 0.0 115.324 -173.07 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 60.2 mt -81.72 174.32 11.47 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.394 0.997 . . . . 0.0 111.611 167.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.34 -97.56 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.93 0.892 . . . . 0.0 111.525 -176.267 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.445 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 49.3 tt0 -145.43 -57.54 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.629 0 O-C-N 120.964 -1.085 . . . . 0.0 110.293 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.445 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.7 Cg_endo -69.76 -37.94 8.49 Favored 'Trans proline' 0 C--N 1.355 0.897 0 CA-C-N 121.581 1.6 . . . . 0.0 112.133 173.109 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.73 -39.85 68.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.699 1.2 . . . . 0.0 112.157 176.451 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -58.17 -46.81 85.09 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.128 1.371 . . . . 0.0 110.74 174.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -56.3 -34.37 62.97 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 125.363 1.459 . . . . 0.0 113.621 175.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -77.61 -30.6 52.46 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 118.622 1.211 . . . . 0.0 111.494 175.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.36 -45.4 60.03 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.541 -0.725 . . . . 0.0 111.291 -178.125 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.79 -34.11 75.0 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.611 -0.709 . . . . 0.0 112.371 173.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.87 -53.58 56.18 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 119.144 0.884 . . . . 0.0 111.614 173.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 72.6 mt -55.41 -37.16 67.26 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.05 0.54 . . . . 0.0 111.328 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -52.51 46.56 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.051 0.94 . . . . 0.0 111.933 177.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -64.68 -38.94 92.71 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.735 -1.228 . . . . 0.0 112.834 178.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.89 -43.76 98.19 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.837 1.255 . . . . 0.0 111.165 172.291 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -60.51 -39.87 89.32 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.533 -0.73 . . . . 0.0 111.566 172.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 59.7 mt -67.13 -35.21 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 119.934 1.243 . . . . 0.0 112.359 177.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -58.02 -49.78 75.68 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.492 0.717 . . . . 0.0 110.32 170.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -93.08 -0.53 57.05 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -173.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt . . . . . 0 N--CA 1.482 1.134 0 C-N-CA 124.437 1.095 . . . . 0.0 112.646 -178.73 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.7 t . . . . . 0 N--CA 1.475 0.782 0 CA-C-O 121.52 0.676 . . . . 0.0 109.951 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -63.24 163.92 9.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.504 1.122 . . . . 0.0 111.689 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.6 p -112.35 149.64 32.18 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.368 1.067 . . . . 0.0 113.072 -173.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.1 t -122.5 129.87 74.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.988 1.715 . . . . 0.0 109.67 -173.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -80.74 179.81 7.62 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.997 1.719 . . . . 0.0 112.537 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.29 -3.41 0.62 Allowed 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 116.603 2.075 . . . . 0.0 116.603 -172.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.7 m -162.6 64.59 0.21 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.671 1.988 . . . . 0.0 109.864 168.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.72 -123.91 6.4 Favored Glycine 0 CA--C 1.53 1.022 0 O-C-N 121.478 -0.764 . . . . 0.0 111.601 -177.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.9 m120 57.25 179.42 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.848 1.259 . . . . 0.0 112.972 -171.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.79 118.6 36.59 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.242 -0.911 . . . . 0.0 109.376 169.465 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.8 mt -84.77 160.87 20.18 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 122.145 0.974 . . . . 0.0 111.611 171.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 15.9 mt -80.33 91.64 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 124.448 1.099 . . . . 0.0 110.4 -173.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 53.4 p -133.24 153.79 51.24 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.699 1.199 . . . . 0.0 110.708 164.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 8.9 tpp85 -70.49 -7.92 47.26 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -162.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -55.36 -44.93 76.45 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 127.108 2.163 . . . . 0.0 115.061 -167.039 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 39.5 pt -60.4 -28.47 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 123.826 0.851 . . . . 0.0 112.828 -173.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 62.5 ttt-85 -68.55 -35.89 78.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 122.672 0.389 . . . . 0.0 110.95 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -79.24 -34.24 42.88 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.283 0.633 . . . . 0.0 111.804 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.8 mp -56.96 -51.59 68.61 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.889 -0.577 . . . . 0.0 111.509 165.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -61.26 -42.96 99.53 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.956 0.798 . . . . 0.0 111.697 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.02 -41.88 97.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.33 0.968 . . . . 0.0 112.668 -179.271 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.92 -44.9 96.56 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.276 -0.89 . . . . 0.0 111.824 178.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -83.68 -8.96 59.17 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.2 mt -78.91 -33.19 45.76 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.812 1.187 . . . . 0.0 112.473 169.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 12.5 t . . . . . 0 N--CA 1.474 0.771 0 CA-C-N 119.259 0.936 . . . . 0.0 112.274 171.076 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 13.9 t0 . . . . . 0 N--CA 1.479 0.994 0 CA-C-O 120.98 0.419 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -69.3 -41.8 76.27 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 120.924 -1.11 . . . . 0.0 112.466 170.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 46.2 tp -51.47 -63.38 1.15 Allowed 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.044 0.537 . . . . 0.0 111.701 175.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -30.66 68.1 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.273 1.029 . . . . 0.0 112.75 177.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.54 -39.9 94.62 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 174.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -62.65 -51.38 67.5 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.062 0.846 . . . . 0.0 111.9 174.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.415 HD12 ' H ' ' A' ' 120' ' ' ILE . 4.4 mp -58.75 -41.53 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.319 0.963 . . . . 0.0 111.118 177.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.1 -18.13 63.94 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -101.32 -33.2 10.13 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -78.52 -45.46 21.87 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.382 1.073 . . . . 0.0 112.45 177.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.431 HD12 ' HB1' ' A' ' 128' ' ' ALA . 2.6 mm? -84.89 174.88 9.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.12 0.968 . . . . 0.0 111.574 176.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -89.85 -99.99 0.1 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.282 0.633 . . . . 0.0 112.288 -177.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.438 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 17.6 tt0 -135.22 -63.9 0.02 OUTLIER Pre-proline 0 N--CA 1.472 0.657 0 O-C-N 120.807 -1.183 . . . . 0.0 109.138 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.438 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 87.5 Cg_endo -68.58 -34.03 20.66 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 CA-C-N 121.127 1.438 . . . . 0.0 111.702 173.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.431 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -60.75 -36.39 78.8 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 120.77 -1.206 . . . . 0.0 112.078 174.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -63.91 -49.51 72.37 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.509 1.124 . . . . 0.0 110.413 172.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.32 -34.13 73.29 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.871 1.224 . . . . 0.0 113.879 178.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -75.08 -33.67 61.69 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.466 1.133 . . . . 0.0 110.682 175.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.47 -46.13 64.36 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.698 -0.626 . . . . 0.0 110.926 -176.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.29 -36.63 79.65 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 118.804 -0.617 . . . . 0.0 112.176 174.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.7 -54.08 49.63 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.301 0.955 . . . . 0.0 111.976 175.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 97.0 mt -58.7 -34.73 71.64 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.395 176.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 49.5 ttp -65.38 -52.02 56.45 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.4 0.68 . . . . 0.0 112.26 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -64.33 -42.9 96.06 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.768 -0.582 . . . . 0.0 111.604 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -61.75 -44.9 95.99 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.604 1.162 . . . . 0.0 111.715 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -59.9 -44.48 94.22 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.155 0.434 . . . . 0.0 111.467 174.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 74.6 mt -62.24 -35.32 68.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 118.686 0.675 . . . . 0.0 111.414 176.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -63.02 -32.19 73.5 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.029 0.932 . . . . 0.0 113.111 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 3.5 p90 -108.81 -0.14 20.05 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 116.242 1.941 . . . . 0.0 116.242 174.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt . . . . . 0 N--CA 1.48 1.072 0 C-N-CA 125.752 1.621 . . . . 0.0 112.634 178.018 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.8 t . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 120.918 0.39 . . . . 0.0 111.397 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -65.78 152.79 43.54 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.801 0.81 . . . . 0.0 111.602 177.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 98.5 p -133.56 157.8 44.77 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.867 0.841 . . . . 0.0 113.002 -173.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.6 t -127.71 130.93 70.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.338 1.455 . . . . 0.0 110.088 -166.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -79.12 173.32 12.7 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.346 1.858 . . . . 0.0 113.632 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.54 -10.12 2.03 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 -177.027 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 19.8 m -138.29 29.88 2.44 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.793 1.637 . . . . 0.0 111.848 175.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 93.13 -109.08 3.74 Favored Glycine 0 C--N 1.339 0.746 0 O-C-N 120.445 -1.409 . . . . 0.0 110.766 -173.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 128' ' ' ALA . 71.4 m-20 52.05 -172.16 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.679 1.191 . . . . 0.0 113.758 -174.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -113.48 126.03 54.87 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 164.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.5 mt -91.61 140.96 29.23 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.338 0.972 . . . . 0.0 110.27 170.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 31.6 mm -80.68 105.46 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.917 0.865 . . . . 0.0 110.851 -178.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.1 p -132.56 22.63 4.33 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 125.255 1.422 . . . . 0.0 113.247 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 64.24 -4.39 0.41 Allowed 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 126.811 2.045 . . . . 0.0 115.88 177.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -54.78 -53.83 50.08 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 129.23 3.012 . . . . 0.0 114.834 178.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 30.2 pt -54.77 -33.3 27.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.928 0.891 . . . . 0.0 113.177 -177.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -65.01 -38.58 91.41 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.984 1.265 . . . . 0.0 112.217 177.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -67.97 -35.11 77.81 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.238 0.615 . . . . 0.0 111.553 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.18 -44.02 80.72 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.807 0.843 . . . . 0.0 111.35 174.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -63.6 -43.6 96.44 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.099 0.863 . . . . 0.0 112.693 171.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -58.09 -46.43 85.51 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.599 1.09 . . . . 0.0 112.75 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.62 -30.97 67.66 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -102.19 -12.17 18.23 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 24.7 mt -74.86 -41.1 60.46 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.617 1.098 . . . . 0.0 111.376 167.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 5.7 t . . . . . 0 CA--C 1.541 0.619 0 CA-C-N 118.322 0.51 . . . . 0.0 110.852 175.875 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 58.6 t0 . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 111.417 0.154 . . . . 0.0 111.417 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -66.23 -35.47 80.51 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 118.451 -0.785 . . . . 0.0 111.821 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.466 ' O ' HD12 ' A' ' 120' ' ' ILE . 55.3 tp -57.94 -61.81 2.27 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.623 0.769 . . . . 0.0 111.025 176.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -60.58 -27.79 67.97 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.278 -0.889 . . . . 0.0 112.726 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.07 -37.53 66.76 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.86 0.864 . . . . 0.0 113.044 173.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -63.68 -53.38 52.22 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.096 -0.954 . . . . 0.0 111.499 174.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.466 HD12 ' O ' ' A' ' 116' ' ' LEU . 3.7 mp -55.79 -36.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 120.633 1.56 . . . . 0.0 111.537 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.451 ' HA ' ' HD2' ' A' ' 129' ' ' ARG . . . -70.68 -24.78 62.74 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.537 1.68 . . . . 0.0 115.537 178.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -99.22 -29.31 12.9 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.997 1.319 . . . . 0.0 113.785 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -82.26 -46.14 14.08 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.484 1.514 . . . . 0.0 113.694 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 7.5 mp -89.21 176.3 7.01 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.02 0.928 . . . . 0.0 110.495 171.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -77.38 -96.94 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.941 0.896 . . . . 0.0 111.767 -175.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.47 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 34.7 tt0 -155.03 -52.65 0.02 OUTLIER Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 124.96 1.304 . . . . 0.0 110.909 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.47 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 56.7 Cg_endo -64.78 -43.9 11.59 Favored 'Trans proline' 0 C--N 1.353 0.804 0 CA-C-N 121.673 1.633 . . . . 0.0 109.948 167.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 86' ' ' ASN . . . -49.97 -38.83 38.68 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.851 1.261 . . . . 0.0 113.007 172.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.463 HH11 ' HD3' ' A' ' 129' ' ' ARG . 26.5 ttt180 -72.19 -42.53 65.73 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 121.602 -0.686 . . . . 0.0 110.869 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.8 -32.62 75.08 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-O 119.524 -0.598 . . . . 0.0 113.976 175.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -79.28 -30.35 42.93 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.34 1.07 . . . . 0.0 111.29 175.301 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.36 -46.91 63.16 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.646 -0.659 . . . . 0.0 111.109 -178.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.7 pp -66.79 -36.63 82.85 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.308 0.643 . . . . 0.0 112.393 175.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.99 -52.0 64.67 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.659 -0.65 . . . . 0.0 112.426 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.86 -28.82 69.76 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.489 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 9.4 tmm? -67.36 -53.47 29.19 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.044 0.838 . . . . 0.0 112.105 175.185 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.59 -42.32 98.69 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.07 -1.019 . . . . 0.0 113.363 172.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.37 -42.29 96.25 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.167 0.987 . . . . 0.0 111.959 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 32.7 t80 -59.56 -43.83 93.46 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.751 -0.593 . . . . 0.0 111.242 171.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.11 -41.74 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-O 118.667 -0.683 . . . . 0.0 112.132 -178.248 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -61.16 -49.91 75.31 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.091 0.956 . . . . 0.0 111.523 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.9 m-30 -89.01 6.62 38.84 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -175.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt . . . . . 0 N--CA 1.479 1.005 0 C-N-CA 125.194 1.397 . . . . 0.0 112.188 174.013 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.4 t . . . . . 0 N--CA 1.475 0.804 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.803 ' HA ' ' OD1' ' A' ' 92' ' ' ASP . 6.6 p90 -147.54 172.96 13.17 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -164.084 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 94.0 p -88.29 168.03 13.05 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.821 2.049 . . . . 0.0 114.883 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 p -154.22 136.89 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 125.541 1.537 . . . . 0.0 111.484 -177.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -84.35 170.95 13.1 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.632 1.173 . . . . 0.0 111.579 173.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.96 3.76 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 117.688 2.477 . . . . 0.0 117.688 -170.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 39.5 m -159.22 52.09 0.38 Allowed 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.008 1.723 . . . . 0.0 110.109 168.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.89 -124.35 6.43 Favored Glycine 0 CA--C 1.528 0.899 0 O-C-N 120.2 -1.562 . . . . 0.0 111.228 -174.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 m120 59.79 177.8 0.09 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.333 1.053 . . . . 0.0 111.615 -169.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.1 mt -112.14 128.23 56.16 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.824 -1.172 . . . . 0.0 109.536 170.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mt -95.52 161.83 13.9 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.992 0.901 . . . . 0.0 111.807 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.4 mm -83.87 89.64 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 124.599 1.16 . . . . 0.0 111.494 -173.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 69.3 p -141.62 166.43 24.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.709 175.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.418 ' CG ' ' HD3' ' A' ' 94' ' ' ARG . 43.7 ttm-85 -93.02 45.41 1.18 Allowed 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 115.005 -0.998 . . . . 0.0 113.398 -164.384 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.803 ' OD1' ' HA ' ' A' ' 79' ' ' PHE . 0.2 OUTLIER -102.71 -60.16 1.59 Allowed 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.614 -0.679 . . . . 0.0 112.691 -178.358 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 20.8 pt -47.41 -24.04 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -176.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.418 ' HD3' ' CG ' ' A' ' 91' ' ' ARG . 9.5 ptm85 -74.06 -31.03 62.69 Favored 'General case' 0 N--CA 1.456 -0.127 0 O-C-N 120.896 -1.127 . . . . 0.0 111.249 -177.312 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -74.4 -32.03 62.55 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.317 1.047 . . . . 0.0 111.032 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.3 tt -63.44 -52.75 60.14 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.577 1.551 . . . . 0.0 110.661 176.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -56.58 -46.01 81.02 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.295 -0.878 . . . . 0.0 112.731 169.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.57 -38.87 85.98 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 119.661 1.119 . . . . 0.0 112.55 -179.163 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.82 -37.17 83.45 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.189 0.996 . . . . 0.0 112.982 178.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -99.85 -3.66 32.07 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 34.7 mt -82.85 -24.06 33.42 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.194 -0.942 . . . . 0.0 112.892 166.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 70.2 m . . . . . 0 N--CA 1.452 -0.338 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 170.257 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 t0 . . . . . 0 CA--C 1.536 0.409 0 N-CA-C 111.48 0.178 . . . . 0.0 111.48 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -72.14 -45.01 62.23 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 117.568 -1.206 . . . . 0.0 111.767 172.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 42.6 tp -49.47 -63.36 1.13 Allowed 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 118.995 0.816 . . . . 0.0 111.791 176.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -60.8 -30.91 70.34 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.911 -1.118 . . . . 0.0 112.709 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.38 -38.03 84.1 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 175.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -60.33 -51.2 70.51 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 119.15 0.886 . . . . 0.0 111.131 173.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.5 mp -58.59 -42.26 84.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-N 119.107 0.867 . . . . 0.0 111.318 175.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.02 -20.97 63.24 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 115.344 1.609 . . . . 0.0 115.344 -178.155 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -98.05 -37.39 9.77 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.881 1.272 . . . . 0.0 113.218 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -73.12 -52.43 14.26 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.724 0.81 . . . . 0.0 112.979 173.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -83.83 159.18 21.44 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 122.4 1.095 . . . . 0.0 109.983 175.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -77.67 -84.41 0.07 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.423 -169.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -153.72 -61.6 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 117.961 -1.018 . . . . 0.0 110.405 -178.18 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -66.65 -38.33 18.83 Favored 'Trans proline' 0 C--N 1.352 0.761 0 CA-C-N 121.437 1.549 . . . . 0.0 110.731 170.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.14 -35.11 71.03 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 121.024 -1.047 . . . . 0.0 112.743 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 35.3 ttt180 -63.4 -47.62 81.23 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.879 1.272 . . . . 0.0 110.379 172.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.06 -34.72 73.77 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.258 1.408 . . . . 0.0 114.148 177.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -75.64 -32.8 60.37 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.356 1.078 . . . . 0.0 110.725 175.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.96 -46.69 64.73 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.734 -0.604 . . . . 0.0 110.968 -177.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.53 -35.35 77.34 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.37 -53.45 56.45 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.488 0.586 . . . . 0.0 112.064 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 88.4 mt -58.47 -34.1 70.5 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.246 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 44.1 ttp -65.53 -50.5 64.99 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.294 0.638 . . . . 0.0 112.469 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -64.65 -44.35 90.72 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.145 0.884 . . . . 0.0 112.172 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -62.2 -38.79 90.47 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.145 0.978 . . . . 0.0 111.426 178.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -62.92 -45.99 89.88 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.152 -0.968 . . . . 0.0 111.777 171.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 70.3 mt -64.96 -34.84 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 121.277 -0.89 . . . . 0.0 112.561 -177.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -61.51 -65.14 0.74 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.715 1.206 . . . . 0.0 110.356 169.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 12.4 m-30 -76.26 -2.94 33.87 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.893 1.277 . . . . 0.0 114.234 -171.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt . . . . . 0 N--CA 1.476 0.847 0 C-N-CA 125.636 1.575 . . . . 0.0 112.035 170.107 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.473 0.711 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -66.31 170.28 6.15 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.161 -0.962 . . . . 0.0 112.573 173.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.1 p -110.38 161.1 15.98 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.959 1.304 . . . . 0.0 113.418 176.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.9 t -123.27 135.56 62.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 125.701 1.6 . . . . 0.0 109.748 -175.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -80.42 173.66 12.38 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.571 1.549 . . . . 0.0 112.767 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.5 -28.73 32.61 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -170.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.8 m -128.88 43.42 3.15 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.588 1.955 . . . . 0.0 111.029 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.25 -122.12 5.84 Favored Glycine 0 CA--C 1.528 0.9 0 O-C-N 120.938 -1.101 . . . . 0.0 111.288 -174.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 56.12 -176.58 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.319 1.048 . . . . 0.0 113.562 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mt -110.1 133.63 53.01 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.214 -0.928 . . . . 0.0 109.575 173.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 12.8 mt -106.31 144.36 33.12 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 122.005 0.907 . . . . 0.0 110.693 169.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 23.4 mt -64.95 113.63 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 124.151 0.98 . . . . 0.0 110.238 -173.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -143.19 142.09 31.33 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.205 1.402 . . . . 0.0 111.344 -175.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 27.0 ttm180 -65.88 -25.49 67.2 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.507 1.123 . . . . 0.0 112.972 -173.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.43 -29.89 68.08 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 128.649 2.78 . . . . 0.0 112.334 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 82.1 mt -56.27 -39.06 57.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.336 1.054 . . . . 0.0 111.647 173.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -68.22 -35.88 78.66 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 121.006 -1.059 . . . . 0.0 112.362 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -66.23 -31.31 72.05 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.058 0.543 . . . . 0.0 111.251 173.521 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.36 -44.63 78.53 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.944 0.897 . . . . 0.0 111.457 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -63.87 -44.96 91.5 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 118.285 -0.864 . . . . 0.0 113.176 167.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -39.79 94.48 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 120.624 1.556 . . . . 0.0 112.453 -177.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.94 -13.05 42.8 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -113.95 -12.17 12.68 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.546 1.138 . . . . 0.0 113.241 172.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 34.0 mt -78.9 -39.53 34.72 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.385 0.993 . . . . 0.0 111.484 172.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.1 p . . . . . 0 N--CA 1.471 0.582 0 CA-C-N 118.986 0.812 . . . . 0.0 110.95 171.362 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.3 t0 . . . . . 0 N--CA 1.468 0.466 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 19.5 ptt-85 -64.74 -31.08 72.15 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 117.846 -1.073 . . . . 0.0 113.356 171.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.21 -61.27 2.48 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.563 1.074 . . . . 0.0 109.995 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -59.35 -29.69 67.85 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.508 1.123 . . . . 0.0 113.189 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.03 -45.21 71.03 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.602 0.761 . . . . 0.0 112.183 173.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -53.42 -48.97 68.26 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.066 0.946 . . . . 0.0 112.597 176.013 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.438 HG22 ' HG3' ' A' ' 129' ' ' ARG . 3.9 mp -62.12 -38.62 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 O-C-N 121.372 -0.83 . . . . 0.0 111.864 175.617 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.66 -24.63 61.06 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -83.64 -42.37 16.76 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.684 1.194 . . . . 0.0 112.486 173.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -79.12 -46.94 17.01 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.702 1.201 . . . . 0.0 113.04 -178.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.484 HD12 ' HB1' ' A' ' 128' ' ' ALA . 2.2 mm? -88.27 171.77 9.93 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 122.654 1.216 . . . . 0.0 110.935 177.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.92 -108.16 0.09 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.736 1.215 . . . . 0.0 111.749 -176.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.445 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 47.7 tt0 -126.68 -63.9 0.02 OUTLIER Pre-proline 0 N--CA 1.47 0.552 0 O-C-N 120.337 -1.477 . . . . 0.0 108.975 -175.095 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.445 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 72.5 Cg_endo -68.78 -38.37 10.35 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 120.764 1.309 . . . . 0.0 111.568 173.001 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.484 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -59.9 -29.65 68.49 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.028 -1.045 . . . . 0.0 111.957 177.051 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.438 ' HG3' HG22 ' A' ' 120' ' ' ILE . 51.6 ttt180 -72.73 -45.45 58.63 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.942 0.401 . . . . 0.0 110.183 177.75 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.57 -35.49 80.73 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 115.459 -0.792 . . . . 0.0 113.762 176.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -72.65 -34.59 67.38 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.467 1.134 . . . . 0.0 110.747 175.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.03 -44.02 61.31 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.167 0.587 . . . . 0.0 111.285 -174.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -69.6 -36.18 75.98 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 119.032 -0.508 . . . . 0.0 112.074 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.66 -53.56 54.55 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.067 0.849 . . . . 0.0 111.782 174.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.4 mt -56.29 -35.29 67.34 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.679 0.792 . . . . 0.0 111.501 175.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 53.4 ttp -66.86 -51.3 57.12 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.434 0.693 . . . . 0.0 112.561 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -64.44 -40.8 96.44 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.436 -0.79 . . . . 0.0 111.66 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -62.06 -43.68 98.3 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.84 1.256 . . . . 0.0 111.377 176.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -60.35 -45.21 94.28 Favored 'General case' 0 C--O 1.221 -0.426 0 O-C-N 121.636 -0.665 . . . . 0.0 111.241 173.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 85.5 mt -67.94 -34.34 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.743 0.817 . . . . 0.0 112.861 -178.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -69.58 -49.69 51.75 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.617 0.767 . . . . 0.0 111.406 172.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 14.0 m-30 -79.93 -0.42 34.96 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.125 -0.984 . . . . 0.0 113.49 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt . . . . . 0 N--CA 1.483 1.197 0 C-N-CA 126.441 1.896 . . . . 0.0 113.316 177.852 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.4 t . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -50.08 156.66 0.75 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 128.509 2.724 . . . . 0.0 114.432 175.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.7 p -106.27 157.81 17.32 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.547 1.139 . . . . 0.0 112.995 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.5 t -124.45 129.92 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.374 1.47 . . . . 0.0 110.0 -171.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -77.32 171.01 15.53 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.985 2.114 . . . . 0.0 113.138 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.14 2.71 0.08 Allowed 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 127.72 2.408 . . . . 0.0 116.373 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 42.7 m -154.05 37.26 0.44 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.529 1.931 . . . . 0.0 111.31 169.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.84 -103.84 3.1 Favored Glycine 0 CA--C 1.527 0.789 0 O-C-N 120.872 -1.143 . . . . 0.0 111.854 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 49.89 -166.89 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.304 1.442 . . . . 0.0 112.88 -172.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mt -122.56 129.99 52.53 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 120.598 -1.314 . . . . 0.0 108.214 162.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.8 mt -99.66 143.3 30.05 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.996 0.903 . . . . 0.0 111.388 174.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 48.3 mm -61.31 125.04 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 123.901 0.88 . . . . 0.0 110.91 -174.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.5 p -155.39 150.6 26.9 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.487 1.915 . . . . 0.0 110.335 -168.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 30.3 ttm180 -88.45 -12.16 43.91 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 -168.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -67.87 -29.38 68.48 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 117.613 -1.184 . . . . 0.0 111.803 169.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 45.4 mm -51.62 -36.56 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 119.972 1.26 . . . . 0.0 112.064 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.4 ttt85 -74.58 -41.16 60.99 Favored 'General case' 0 CA--C 1.521 -0.15 0 O-C-N 121.007 -1.058 . . . . 0.0 110.775 178.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -64.78 -28.28 69.47 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.437 176.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 tt -64.77 -47.75 77.01 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.478 1.511 . . . . 0.0 110.866 174.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -66.68 -42.3 86.75 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.61 -0.682 . . . . 0.0 112.451 171.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -58.12 -43.91 87.44 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.574 1.079 . . . . 0.0 112.842 177.172 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.69 -34.33 75.57 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -175.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -88.04 -32.19 18.91 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.525 1.13 . . . . 0.0 113.001 178.007 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.8 mt -57.21 -51.06 70.87 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.824 1.193 . . . . 0.0 110.696 170.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 62.6 m . . . . . 0 CA--C 1.539 0.527 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 177.694 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.71 -39.34 84.37 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.42 -0.8 . . . . 0.0 112.94 172.566 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 35.2 tp -59.65 -57.71 11.77 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.542 1.065 . . . . 0.0 111.917 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -23.24 66.76 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.037 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.61 -31.14 32.63 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.316 1.046 . . . . 0.0 113.04 176.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.66 -44.45 56.77 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.546 0.739 . . . . 0.0 110.484 173.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 15.3 mt -57.59 -41.26 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 CA-C-O 121.525 0.679 . . . . 0.0 111.533 173.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.46 -21.31 66.63 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -95.02 -23.12 17.5 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 176.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -90.64 -40.35 11.95 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 35.3 mt -83.81 179.7 7.51 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.776 2.031 . . . . 0.0 113.301 177.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 33.5 tp60 -91.43 -96.05 0.12 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.63 1.172 . . . . 0.0 112.167 -173.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.489 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 35.3 tt0 -140.85 -62.22 0.02 OUTLIER Pre-proline 0 N--CA 1.47 0.558 0 O-C-N 120.716 -1.24 . . . . 0.0 109.956 170.443 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.489 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 59.8 Cg_endo -65.57 -35.76 36.73 Favored 'Trans proline' 0 C--N 1.352 0.761 0 CA-C-N 121.276 1.491 . . . . 0.0 111.106 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -47.84 -47.74 31.25 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.999 1.319 . . . . 0.0 112.628 168.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -62.76 -48.03 80.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.965 1.306 . . . . 0.0 110.458 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.13 -34.77 74.43 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.568 1.08 . . . . 0.0 113.649 178.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -75.77 -33.48 60.2 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.483 1.142 . . . . 0.0 110.986 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.2 61.2 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.691 -0.63 . . . . 0.0 111.055 -174.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -67.05 -36.84 82.94 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.967 173.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.11 -55.18 35.45 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 119.378 0.99 . . . . 0.0 111.312 175.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 92.4 mt -53.79 -36.63 62.64 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.283 1.033 . . . . 0.0 111.847 174.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 40.9 ttp -67.2 -50.6 60.3 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.648 0.658 . . . . 0.0 112.353 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -64.58 -43.58 93.39 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.454 -0.778 . . . . 0.0 111.271 177.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -62.93 -39.09 93.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.604 1.562 . . . . 0.0 112.377 178.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -64.06 -39.99 95.28 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.167 -0.958 . . . . 0.0 111.985 173.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 83.9 mt -72.18 -35.07 51.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.233 1.013 . . . . 0.0 112.059 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 62.0 t0 -62.42 -62.59 1.65 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.07 2.148 . . . . 0.0 110.81 172.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -78.87 -1.21 33.96 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -177.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 23.0 ttmt . . . . . 0 N--CA 1.482 1.13 0 C-N-CA 124.715 1.206 . . . . 0.0 112.878 -173.564 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.48 1.029 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -77.53 -176.02 4.07 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.917 1.287 . . . . 0.0 112.083 176.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.5 p -147.36 166.42 27.19 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 120.574 -1.328 . . . . 0.0 112.772 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 p -135.66 130.28 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.063 1.745 . . . . 0.0 111.379 -165.047 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -75.38 168.97 18.98 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.701 2.0 . . . . 0.0 112.548 172.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -50.29 -17.25 0.42 Allowed 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 -176.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.9 m -139.09 41.9 2.09 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 127.411 2.285 . . . . 0.0 111.674 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 92.38 -123.93 7.48 Favored Glycine 0 C--N 1.35 1.338 0 O-C-N 119.524 -1.985 . . . . 0.0 110.372 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 62.7 m-20 55.92 -178.94 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.584 1.153 . . . . 0.0 112.677 -171.153 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.48 114.84 28.22 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 172.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 12.1 mt -83.49 148.39 27.26 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 122.161 0.981 . . . . 0.0 111.951 175.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 22.9 mt -66.51 101.19 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.612 1.165 . . . . 0.0 110.089 -173.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -145.96 138.96 25.84 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.652 1.581 . . . . 0.0 110.086 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 34.5 ttp180 -78.29 42.35 0.41 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.119 1.368 . . . . 0.0 113.739 -170.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.33 -59.59 2.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.292 1.037 . . . . 0.0 113.317 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.0 pt -54.31 -31.3 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.426 1.49 . . . . 0.0 114.297 -167.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -60.09 -40.43 89.58 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.644 -0.66 . . . . 0.0 112.299 176.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -73.82 -32.39 63.68 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.52 0.728 . . . . 0.0 109.741 -173.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.1 mp -60.77 -51.01 71.16 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.619 0.767 . . . . 0.0 110.885 167.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.6 m-30 -60.17 -45.27 93.67 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 118.382 -0.818 . . . . 0.0 112.292 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -62.68 -38.05 88.83 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.536 1.134 . . . . 0.0 112.659 178.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.11 -41.29 97.3 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.206 0.912 . . . . 0.0 111.902 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -84.61 -28.24 26.65 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.571 -0.705 . . . . 0.0 112.665 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 43.8 mt -59.01 -33.29 70.55 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.643 1.11 . . . . 0.0 111.195 166.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.2 m . . . . . 0 CA--C 1.544 0.732 0 C-N-CA 125.595 1.558 . . . . 0.0 113.952 175.677 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.471 0.578 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 33.2 ptt180 -70.09 -32.68 70.86 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 118.625 -0.702 . . . . 0.0 112.881 171.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.4 tt -57.52 -60.38 3.75 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.966 0.803 . . . . 0.0 109.991 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.56 -31.92 66.6 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.804 0.841 . . . . 0.0 112.162 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.4 -37.52 80.41 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.118 0.567 . . . . 0.0 112.173 -177.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -61.18 -50.13 74.37 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.492 171.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.402 HD12 ' H ' ' A' ' 120' ' ' ILE . 4.3 mp -60.15 -39.49 80.68 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.413 0 CA-C-N 119.161 0.891 . . . . 0.0 111.578 177.119 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.85 -21.46 63.35 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -99.59 -21.38 15.9 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.73 1.212 . . . . 0.0 114.167 176.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -104.68 -38.12 6.83 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 120.357 -0.537 . . . . 0.0 112.237 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -87.67 156.63 19.38 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 122.491 1.139 . . . . 0.0 110.096 169.27 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.61 -88.47 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.944 0.898 . . . . 0.0 112.371 -166.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -150.07 -58.48 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.735 0 O-C-N 121.096 -1.003 . . . . 0.0 111.01 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -69.66 -36.24 11.43 Favored 'Trans proline' 0 C--N 1.353 0.776 0 CA-C-N 121.637 1.621 . . . . 0.0 111.113 167.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.97 -39.46 81.81 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 120.945 -1.097 . . . . 0.0 111.847 173.254 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 43.2 ttt180 -60.4 -51.24 70.33 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.211 1.405 . . . . 0.0 110.167 172.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -60.0 -31.02 71.32 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.018 1.294 . . . . 0.0 114.57 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.68 -30.23 41.05 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.768 1.284 . . . . 0.0 111.039 173.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.92 -44.3 55.51 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.414 -0.804 . . . . 0.0 111.138 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -66.99 -34.78 78.5 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 174.198 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.54 -56.36 22.27 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.003 0.521 . . . . 0.0 111.206 172.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.9 mp -58.45 -33.18 69.44 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.568 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 49.8 ttp -63.3 -48.21 79.03 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.708 0.803 . . . . 0.0 112.887 175.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -75.36 -29.54 59.94 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 120.761 -1.212 . . . . 0.0 112.775 176.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -69.13 -41.99 76.63 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 124.873 1.269 . . . . 0.0 110.703 -178.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -35.24 79.63 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.687 -0.633 . . . . 0.0 111.072 176.544 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 87.8 mt -65.77 -40.31 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.797 0.839 . . . . 0.0 110.952 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -60.01 -19.28 51.73 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.442 1.097 . . . . 0.0 113.918 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -118.77 3.84 11.6 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.414 1.485 . . . . 0.0 114.385 176.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 11.9 tppt? . . . . . 0 N--CA 1.48 1.058 0 C-N-CA 124.663 1.185 . . . . 0.0 112.234 -177.623 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.3 t . . . . . 0 CA--C 1.551 0.981 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -51.48 170.27 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 129.388 3.075 . . . . 0.0 115.517 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.6 p -107.52 162.89 13.53 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.449 1.5 . . . . 0.0 113.82 173.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.6 t -130.07 135.88 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.106 1.762 . . . . 0.0 109.728 -173.722 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -80.2 174.77 11.26 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.445 1.498 . . . . 0.0 112.406 177.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.52 -13.31 1.47 Allowed 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 116.279 1.955 . . . . 0.0 116.279 -172.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 9.4 m -151.7 54.54 0.84 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.12 1.768 . . . . 0.0 111.027 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.0 -120.8 5.4 Favored Glycine 0 CA--C 1.527 0.795 0 O-C-N 121.191 -0.943 . . . . 0.0 111.049 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 55.1 -178.81 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.107 0 CA-C-N 118.067 0.933 . . . . 0.0 112.329 -168.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -108.82 123.4 48.99 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.555 -1.341 . . . . 0.0 108.098 166.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.8 mt -87.08 147.79 25.53 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 120.253 1.388 . . . . 0.0 111.06 173.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 42.5 mm -67.67 95.93 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.495 1.118 . . . . 0.0 110.932 -176.115 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.7 p -136.2 142.78 44.13 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.085 1.354 . . . . 0.0 110.804 173.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.5 ttm180 -68.52 13.13 0.1 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.331 1.452 . . . . 0.0 114.805 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -62.88 -63.44 1.21 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.529 1.531 . . . . 0.0 112.495 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 45.7 pt -55.53 -26.88 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 126.236 1.814 . . . . 0.0 115.644 -169.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -65.79 -33.33 75.61 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.932 -1.105 . . . . 0.0 112.53 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -71.5 -35.44 70.77 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.527 0.731 . . . . 0.0 110.422 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tt -63.99 -49.46 72.4 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.059 1.344 . . . . 0.0 110.595 175.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -58.04 -46.83 84.71 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.047 -0.978 . . . . 0.0 113.154 170.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -64.43 -37.94 89.27 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 120.96 1.709 . . . . 0.0 112.148 -178.048 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.48 -41.51 89.93 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.473 -0.767 . . . . 0.0 112.361 176.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -89.26 -13.55 37.88 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 67.3 mt -74.64 -35.78 62.87 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.613 1.097 . . . . 0.0 111.455 163.16 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.9 t . . . . . 0 N--CA 1.471 0.6 0 C-N-CA 123.798 0.839 . . . . 0.0 111.39 170.827 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 21.6 t70 . . . . . 0 N--CA 1.47 0.538 0 CA-C-O 121.489 0.662 . . . . 0.0 111.442 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -72.88 -42.39 63.7 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.496 0.718 . . . . 0.0 111.642 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.435 ' O ' HD12 ' A' ' 120' ' ' ILE . 57.3 tp -51.45 -59.93 3.7 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.909 0.883 . . . . 0.0 111.875 174.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.7 ppt_? -64.57 -20.95 66.55 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.03 -1.044 . . . . 0.0 113.526 -177.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -74.47 -45.84 43.5 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 124.123 0.889 . . . . 0.0 112.181 169.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -57.43 -50.9 71.53 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 118.962 0.801 . . . . 0.0 112.284 177.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.435 HD12 ' O ' ' A' ' 116' ' ' LEU . 4.0 mp -59.79 -41.78 86.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 119.587 1.085 . . . . 0.0 111.598 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.07 -32.8 73.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.41 33.06 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.179 -0.951 . . . . 0.0 110.645 175.114 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -71.61 -53.23 14.34 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.257 0.623 . . . . 0.0 112.303 -174.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.1 mt -81.1 166.54 20.61 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.162 0.506 . . . . 0.0 111.566 174.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -85.12 -87.46 0.12 Allowed 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -165.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.427 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 20.8 tt0 -143.02 -62.83 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.127 1.371 . . . . 0.0 109.782 169.232 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.427 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 63.2 Cg_endo -64.54 -37.23 39.03 Favored 'Trans proline' 0 C--N 1.356 0.926 0 CA-C-N 121.993 1.748 . . . . 0.0 112.27 177.063 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.04 -38.37 65.14 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.028 -1.045 . . . . 0.0 112.529 172.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -49.27 78.42 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.959 1.704 . . . . 0.0 110.557 176.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.8 -32.83 70.83 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 126.771 2.129 . . . . 0.0 114.32 175.052 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -78.26 -30.59 48.68 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.721 1.26 . . . . 0.0 110.909 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.76 -46.44 62.94 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.841 0.746 . . . . 0.0 111.306 -177.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.8 pp -64.9 -39.36 93.41 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.755 0.422 . . . . 0.0 111.898 174.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.62 -52.69 62.35 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.654 -0.654 . . . . 0.0 112.308 175.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.5 -29.45 69.09 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 117.877 -1.058 . . . . 0.0 111.817 176.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 46.3 ttp -66.65 -50.91 61.42 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.475 1.034 . . . . 0.0 111.771 174.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -67.68 -38.78 84.19 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.301 -0.874 . . . . 0.0 112.127 178.276 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -65.18 -41.21 94.84 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.988 1.315 . . . . 0.0 112.016 176.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -59.71 -37.51 79.08 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 121.331 -0.856 . . . . 0.0 111.503 172.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 84.1 mt -72.79 -40.98 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 123.834 0.854 . . . . 0.0 112.004 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -57.79 -51.12 70.88 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.528 1.131 . . . . 0.0 111.289 170.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 7.5 m-30 -89.13 11.38 18.75 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.384 1.074 . . . . 0.0 113.289 -176.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt . . . . . 0 N--CA 1.481 1.097 0 C-N-CA 124.355 1.062 . . . . 0.0 112.358 178.725 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.6 t . . . . . 0 CA--C 1.549 0.914 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -65.47 164.6 13.59 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.61 1.564 . . . . 0.0 112.205 177.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.7 p -120.36 156.15 31.93 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.702 1.201 . . . . 0.0 112.517 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.4 t -121.62 128.85 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 125.77 1.628 . . . . 0.0 108.624 -173.02 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -76.61 179.84 5.73 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.291 1.036 . . . . 0.0 112.636 176.425 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.73 -29.25 17.78 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 -168.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.3 m -143.55 84.85 1.82 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.654 1.582 . . . . 0.0 109.22 169.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 67.15 -124.3 22.63 Favored Glycine 0 CA--C 1.533 1.199 0 O-C-N 122.07 -0.394 . . . . 0.0 113.086 -177.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 57.31 178.92 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.858 1.263 . . . . 0.0 113.235 -168.216 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -113.05 125.76 54.74 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 164.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.6 mt -85.7 158.56 20.02 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 118.848 0.749 . . . . 0.0 110.228 169.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 39.8 mm -69.77 119.81 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.421 0.688 . . . . 0.0 110.437 179.44 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.7 p -147.46 162.16 39.6 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.733 0.813 . . . . 0.0 111.383 177.304 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -92.05 -19.79 21.98 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.922 -0.486 . . . . 0.0 111.815 -175.385 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.6 -29.5 37.98 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 173.248 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.0 mm -55.05 -34.93 33.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 O-C-N 120.794 -1.191 . . . . 0.0 111.433 -177.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -84.77 -18.67 34.33 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 121.171 -0.956 . . . . 0.0 111.613 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -73.77 -30.04 62.54 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.208 0.603 . . . . 0.0 110.501 173.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.8 mp -66.54 -57.01 8.18 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.428 0.558 . . . . 0.0 110.853 171.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -53.66 -46.55 70.63 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.346 177.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -60.66 -40.31 91.59 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.517 1.053 . . . . 0.0 112.715 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.41 -46.29 87.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.139 -0.975 . . . . 0.0 112.333 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -78.78 -21.12 48.3 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.0 mt -69.05 -37.1 78.37 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 119.439 1.018 . . . . 0.0 112.574 171.078 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.479 1.004 0 CA-C-N 119.152 0.887 . . . . 0.0 112.154 171.824 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 . . . . . 0 CA--C 1.532 0.285 0 CA-C-O 120.487 0.184 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -72.77 -37.6 67.57 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 117.998 -1.001 . . . . 0.0 111.577 -176.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 52.3 tp -54.98 -63.67 1.08 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.524 0.73 . . . . 0.0 111.558 173.076 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.76 -22.28 66.83 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 117.523 -1.227 . . . . 0.0 113.427 -177.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.92 -44.71 54.23 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 124.21 0.944 . . . . 0.0 112.287 168.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -53.17 -50.53 64.4 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.75 1.22 . . . . 0.0 112.315 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.0 mp -60.72 -39.37 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 O-C-N 121.63 -0.669 . . . . 0.0 111.955 177.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -75.2 -15.95 60.52 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -98.57 -35.39 10.23 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.127 1.371 . . . . 0.0 113.296 175.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -82.91 -39.41 21.53 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.917 0.887 . . . . 0.0 112.214 175.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 83.6 mt -93.95 168.32 11.04 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.387 1.089 . . . . 0.0 112.285 168.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.9 -91.35 0.09 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.63 1.172 . . . . 0.0 112.31 -164.238 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.444 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 19.5 tt0 -146.07 -55.12 0.02 OUTLIER Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.932 1.293 . . . . 0.0 111.281 173.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.444 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 57.6 Cg_endo -68.34 -43.32 4.49 Favored 'Trans proline' 0 C--N 1.356 0.949 0 CA-C-N 121.921 1.722 . . . . 0.0 111.726 173.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -48.92 -39.47 26.27 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.648 1.579 . . . . 0.0 113.142 173.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.87 -45.13 95.79 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.183 1.393 . . . . 0.0 111.355 176.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.95 -35.17 82.11 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 125.485 1.517 . . . . 0.0 113.707 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -73.73 -32.92 64.1 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.362 1.081 . . . . 0.0 110.68 174.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.09 -45.0 62.35 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.173 0.589 . . . . 0.0 111.565 -176.002 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.07 -37.06 80.84 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.338 0.655 . . . . 0.0 112.259 175.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.9 -51.51 66.67 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.304 0.502 . . . . 0.0 112.012 173.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.7 mp -58.37 -30.1 66.52 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 117.874 -1.06 . . . . 0.0 111.646 175.039 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.432 ' SD ' HD11 ' A' ' 140' ' ' ILE . 0.0 OUTLIER -63.78 -57.36 10.17 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.067 0.848 . . . . 0.0 111.483 175.682 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -66.72 -37.24 84.29 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.215 -0.928 . . . . 0.0 112.395 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -62.8 -38.95 92.71 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.189 1.396 . . . . 0.0 112.203 173.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -65.32 -43.19 91.81 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.368 -0.832 . . . . 0.0 111.27 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 136' ' ' MET . 55.6 mt -62.43 -38.76 82.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-O 118.406 -0.807 . . . . 0.0 112.419 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -57.2 -23.05 45.17 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.963 0.905 . . . . 0.0 112.786 175.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -118.1 6.6 12.08 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.381 1.472 . . . . 0.0 114.455 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? . . . . . 0 N--CA 1.478 0.935 0 C-N-CA 124.64 1.176 . . . . 0.0 113.857 -176.92 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.4 t . . . . . 0 CA--C 1.54 0.593 0 CA-C-O 122.785 1.279 . . . . 0.0 109.71 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -95.6 161.19 14.15 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 127.399 2.279 . . . . 0.0 112.228 177.133 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 p -92.23 155.35 18.04 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.597 1.559 . . . . 0.0 113.259 171.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 27.7 m -131.75 159.48 43.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 125.998 1.719 . . . . 0.0 110.438 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -91.35 -178.95 5.27 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.043 1.737 . . . . 0.0 112.715 -177.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.72 15.62 0.1 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.113 1.765 . . . . 0.0 115.528 -173.146 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.5 m -160.49 38.93 0.17 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.966 2.107 . . . . 0.0 110.547 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.69 -122.51 7.16 Favored Glycine 0 CA--C 1.529 0.961 0 O-C-N 121.035 -1.041 . . . . 0.0 110.981 -166.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 57.07 -174.9 0.07 Allowed 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 118.182 0.991 . . . . 0.0 112.996 -171.316 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 87' ' ' LEU . 4.2 mt -108.58 134.56 51.17 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.942 0.897 . . . . 0.0 108.985 171.454 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.7 164.3 12.64 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.715 0.806 . . . . 0.0 111.374 175.017 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 39.3 mm -66.43 108.86 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.025 0.93 . . . . 0.0 111.231 175.37 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 10.1 t -155.93 162.96 40.31 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.838 1.255 . . . . 0.0 111.675 170.198 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -94.26 9.09 39.42 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -57.03 -46.14 82.62 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 121.156 -0.965 . . . . 0.0 111.981 172.377 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.5 pt -56.46 -33.33 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.519 1.128 . . . . 0.0 113.622 178.02 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 40.0 ttt85 -61.33 -45.1 95.84 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 118.696 0.68 . . . . 0.0 110.706 173.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -68.01 -33.4 74.55 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.153 0.581 . . . . 0.0 111.334 -178.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.3 mp -62.82 -52.56 62.68 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.843 0.747 . . . . 0.0 112.017 168.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.71 -42.9 98.16 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.306 0.957 . . . . 0.0 112.749 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -62.94 -43.88 97.6 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.526 1.057 . . . . 0.0 111.717 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.81 -36.72 79.78 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -90.2 -24.77 20.91 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 31.6 mt -63.59 -44.63 93.46 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 119.308 0.958 . . . . 0.0 111.544 173.424 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.9 t . . . . . 0 N--CA 1.476 0.833 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 176.58 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.3 t0 . . . . . 0 N--CA 1.468 0.475 0 CA-C-O 121.265 0.555 . . . . 0.0 111.816 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 18.3 mmt85 -64.2 -43.62 94.46 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.112 0.565 . . . . 0.0 110.721 171.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.452 ' O ' HD12 ' A' ' 120' ' ' ILE . 54.8 tp -56.1 -56.16 24.18 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.434 0.694 . . . . 0.0 112.153 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -55.77 -37.01 67.98 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 119.256 0.935 . . . . 0.0 112.285 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.71 -41.35 92.41 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.807 0.843 . . . . 0.0 112.431 178.614 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -61.58 -49.04 78.26 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 118.558 -0.734 . . . . 0.0 111.958 173.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.452 HD12 ' O ' ' A' ' 116' ' ' LEU . 3.5 mp -57.94 -45.81 87.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.794 1.179 . . . . 0.0 111.195 175.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.84 -32.96 74.9 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -80.64 -45.77 16.7 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.997 0.817 . . . . 0.0 112.708 177.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -66.0 -51.87 54.44 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.993 1.317 . . . . 0.0 112.985 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.508 HD12 ' HB1' ' A' ' 128' ' ' ALA . 3.7 mm? -75.9 -160.92 0.15 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.836 1.255 . . . . 0.0 112.102 -178.302 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.54 -105.48 0.39 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.08 1.352 . . . . 0.0 109.239 173.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.405 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 56.7 tt0 -127.54 -64.38 0.02 OUTLIER Pre-proline 0 N--CA 1.468 0.464 0 O-C-N 120.126 -1.609 . . . . 0.0 110.162 -176.503 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.405 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 77.6 Cg_endo -67.08 -30.95 37.8 Favored 'Trans proline' 0 C--N 1.349 0.574 0 CA-C-N 121.206 1.467 . . . . 0.0 111.561 173.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.508 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -63.6 -35.41 80.41 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 120.794 -1.191 . . . . 0.0 112.267 172.805 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -64.55 -47.3 79.3 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.971 0.908 . . . . 0.0 110.125 170.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.8 -34.54 78.1 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.138 1.352 . . . . 0.0 114.008 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -33.15 64.84 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.812 1.306 . . . . 0.0 110.041 175.324 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.38 -43.42 60.62 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.372 0.669 . . . . 0.0 111.558 -174.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -69.49 -35.54 75.67 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.094 0.557 . . . . 0.0 112.439 174.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.84 -50.51 70.65 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 122.937 0.495 . . . . 0.0 111.923 172.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.7 mp -57.79 -31.98 67.1 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 117.619 -1.182 . . . . 0.0 111.916 173.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 2.3 tpt -64.53 -52.32 58.34 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.611 1.096 . . . . 0.0 111.137 174.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 38.3 mm-40 -62.4 -43.08 99.66 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.104 0.562 . . . . 0.0 112.46 177.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -41.82 86.23 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.64 1.176 . . . . 0.0 111.985 -179.405 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -60.88 -42.68 98.4 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.852 0.751 . . . . 0.0 111.332 170.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 68.3 mt -62.5 -28.74 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-O 119.182 -0.437 . . . . 0.0 111.089 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -76.9 -31.21 56.57 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.656 -176.52 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.3 p90 -102.55 3.31 37.28 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 174.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 9.9 ttpt . . . . . 0 N--CA 1.484 1.251 0 C-N-CA 125.465 1.506 . . . . 0.0 113.585 -179.383 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 CA--C 1.551 1.002 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -67.66 161.88 24.88 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.803 1.241 . . . . 0.0 112.788 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 73.4 p -147.52 163.17 37.41 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.958 0.903 . . . . 0.0 113.201 -178.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.8 p -127.99 130.2 69.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.675 1.59 . . . . 0.0 111.975 -167.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -82.75 178.9 7.96 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.653 1.581 . . . . 0.0 113.336 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.43 -7.01 0.2 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.483 2.313 . . . . 0.0 117.203 -173.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.3 m -161.53 75.84 0.5 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 126.041 1.736 . . . . 0.0 109.864 161.273 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 73.58 -127.3 10.47 Favored Glycine 0 CA--C 1.528 0.874 0 O-C-N 121.169 -0.957 . . . . 0.0 110.939 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.8 m120 57.84 175.95 0.05 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.357 1.063 . . . . 0.0 111.372 -166.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.4 125.84 52.2 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.629 -1.294 . . . . 0.0 108.26 167.169 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.9 mt -84.29 166.33 17.56 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 118.925 0.784 . . . . 0.0 111.959 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 38.2 mm -73.49 94.96 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 124.583 1.153 . . . . 0.0 112.127 -173.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 46.3 p -138.03 148.05 44.74 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.933 1.693 . . . . 0.0 111.58 177.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.31 6.04 48.33 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -174.707 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -59.48 -39.01 82.37 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.979 0.912 . . . . 0.0 110.906 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 32.8 pt -55.53 -37.09 44.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 125.792 1.637 . . . . 0.0 113.356 176.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 -61.18 -55.22 34.73 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.238 1.015 . . . . 0.0 109.888 176.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -66.48 -31.81 72.78 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.534 0.733 . . . . 0.0 112.305 -179.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 8.7 mt -62.51 -53.4 55.26 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.165 0.986 . . . . 0.0 112.497 172.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -59.8 -46.24 89.83 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.68 0.673 . . . . 0.0 110.867 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -65.16 -34.17 77.74 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -177.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.02 -44.7 79.62 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.149 -0.97 . . . . 0.0 112.664 173.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -74.62 -31.22 61.93 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.495 -0.753 . . . . 0.0 112.293 179.319 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.0 mt -63.49 -39.84 95.5 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.814 0.734 . . . . 0.0 110.465 169.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 172.155 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 110.637 -0.134 . . . . 0.0 110.637 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -57.63 -45.16 85.76 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.872 0.869 . . . . 0.0 111.642 174.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 38.7 tp -62.65 -56.57 16.56 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.515 0.726 . . . . 0.0 112.461 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -22.52 65.54 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.179 -0.951 . . . . 0.0 113.328 -177.477 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -72.64 -40.17 66.61 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.137 0.975 . . . . 0.0 113.126 174.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -42.9 74.06 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.647 0.658 . . . . 0.0 110.486 177.144 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 17.8 mt -57.06 -40.97 76.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 121.575 -0.703 . . . . 0.0 110.955 173.482 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.85 -23.15 64.2 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -79.34 -29.63 42.33 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 174.152 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -107.37 -37.5 6.21 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -170.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -88.51 156.72 18.93 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.291 1.436 . . . . 0.0 111.664 175.301 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -75.98 -69.03 0.52 Allowed 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 -157.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -165.21 -56.82 0.01 OUTLIER Pre-proline 0 N--CA 1.479 0.985 0 C-N-CA 127.147 2.179 . . . . 0.0 109.794 168.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -69.78 -39.69 6.16 Favored 'Trans proline' 0 C--N 1.356 0.927 0 CA-C-N 121.446 1.552 . . . . 0.0 111.498 173.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.34 -40.26 61.72 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.75 1.22 . . . . 0.0 112.35 175.154 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -60.23 -48.36 82.04 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.493 1.517 . . . . 0.0 111.163 174.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.52 -34.05 74.23 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.52 1.533 . . . . 0.0 113.625 177.505 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -73.83 -34.46 64.56 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.437 1.118 . . . . 0.0 110.906 175.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.78 -46.61 68.29 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 122.876 0.47 . . . . 0.0 110.902 -176.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -71.08 -33.57 70.33 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 175.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.17 -53.02 59.82 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 118.826 0.739 . . . . 0.0 112.257 173.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.16 -34.22 70.06 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.673 0.789 . . . . 0.0 111.242 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 48.3 ttp -64.93 -52.93 53.68 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.601 0.761 . . . . 0.0 112.37 175.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -64.81 -37.64 88.3 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.587 -0.696 . . . . 0.0 112.428 178.086 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -64.35 -43.35 94.85 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.344 1.058 . . . . 0.0 112.309 175.029 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' TYR . . . . . 0.437 ' O ' ' HE2' ' A' ' 143' ' ' LYS . 73.4 t80 -59.93 -39.47 85.6 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.44 -0.788 . . . . 0.0 111.465 175.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 88.3 mt -72.16 -41.87 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.079 1.351 . . . . 0.0 112.867 176.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -55.0 -53.24 58.26 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.134 1.374 . . . . 0.0 110.028 172.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -79.52 7.93 7.29 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 120.935 -1.103 . . . . 0.0 113.231 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.437 ' HE2' ' O ' ' A' ' 139' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.61 0 C-N-CA 124.093 0.957 . . . . 0.0 112.679 166.77 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.8 t . . . . . 0 N--CA 1.468 0.455 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -169.79 178.09 4.19 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.217 1.807 . . . . 0.0 110.4 -176.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 53.9 p -137.11 159.67 41.21 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.739 1.216 . . . . 0.0 112.644 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.0 p -128.33 130.92 69.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 126.52 1.928 . . . . 0.0 111.52 -169.148 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -77.95 170.03 17.28 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 126.203 1.801 . . . . 0.0 111.644 173.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.34 -1.79 0.15 Allowed 'General case' 0 CA--C 1.558 1.265 0 N-CA-C 117.071 2.248 . . . . 0.0 117.071 -173.202 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 18.0 m -147.38 39.42 0.99 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.534 1.933 . . . . 0.0 112.094 175.252 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 86.94 -121.15 5.69 Favored Glycine 0 C--N 1.342 0.913 0 N-CA-C 109.951 -1.259 . . . . 0.0 109.951 -173.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 20.4 m120 57.37 175.47 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.091 0.956 . . . . 0.0 112.764 -166.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.44 120.55 42.21 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 164.503 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.0 mt -84.15 161.0 20.76 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.14 0.882 . . . . 0.0 110.922 170.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 17.9 mt -75.17 99.08 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 124.301 1.04 . . . . 0.0 110.888 -173.16 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 31.9 p -113.18 155.48 24.94 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.842 0.857 . . . . 0.0 110.595 162.56 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.521 ' O ' ' HG2' ' A' ' 94' ' ' ARG . 1.5 tpm_? -72.02 -33.08 67.76 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.206 -0.934 . . . . 0.0 111.469 173.353 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -53.36 -34.55 58.02 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 127.198 2.199 . . . . 0.0 113.447 -167.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 55.3 mt -44.38 -35.97 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 126.424 1.89 . . . . 0.0 112.782 173.181 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 91' ' ' ARG . 19.9 ptt85 -79.9 -24.92 40.8 Favored 'General case' 0 C--N 1.339 0.137 0 O-C-N 121.494 -0.754 . . . . 0.0 111.829 -173.221 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -73.61 -30.73 63.17 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.175 0.99 . . . . 0.0 110.019 175.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.4 -45.09 89.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.738 0.815 . . . . 0.0 111.425 172.073 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -60.99 -47.96 84.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 118.127 -0.94 . . . . 0.0 112.715 170.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.7 -41.67 97.9 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 120.355 1.434 . . . . 0.0 112.148 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.24 -22.68 63.33 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 177.484 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -106.31 -22.49 12.81 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.3 mt -64.05 -51.16 65.43 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.977 1.262 . . . . 0.0 109.833 171.141 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.8 m . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 172.725 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.7 t70 . . . . . 0 CA--C 1.541 0.633 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 38.8 ptt85 -73.5 -32.37 64.24 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 172.019 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 43.9 tp -65.23 -58.26 6.4 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.998 0.817 . . . . 0.0 111.013 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.85 -30.81 67.98 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.334 -0.854 . . . . 0.0 112.017 178.904 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.97 -44.05 81.47 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 122.89 0.476 . . . . 0.0 111.988 174.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -53.36 -56.4 17.03 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.341 1.057 . . . . 0.0 112.049 173.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.404 HD12 ' H ' ' A' ' 120' ' ' ILE . 4.2 mp -60.54 -41.03 86.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 121.637 -0.664 . . . . 0.0 111.562 177.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.18 -24.22 64.94 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.31 -33.2 16.19 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.96 0.904 . . . . 0.0 113.062 173.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.54 -48.84 14.43 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.397 1.479 . . . . 0.0 113.342 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -92.36 155.15 18.1 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.66 1.584 . . . . 0.0 111.049 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -76.42 -74.16 0.24 Allowed 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 114.967 -1.015 . . . . 0.0 113.47 -159.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -158.12 -58.43 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.704 0 C-N-CA 125.102 1.361 . . . . 0.0 110.377 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -70.16 -41.22 3.94 Favored 'Trans proline' 0 C--N 1.353 0.81 0 CA-C-N 121.047 1.41 . . . . 0.0 111.321 171.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.25 -37.47 67.26 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.926 1.29 . . . . 0.0 113.12 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 20.1 ttt-85 -56.59 -50.93 70.52 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.253 1.821 . . . . 0.0 111.104 172.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.72 -30.54 62.8 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.408 1.48 . . . . 0.0 114.376 177.343 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -80.77 -30.6 36.0 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.412 1.106 . . . . 0.0 111.598 173.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.55 -45.9 64.59 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.635 -0.666 . . . . 0.0 111.043 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -66.34 -34.46 78.03 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.253 0.621 . . . . 0.0 112.638 174.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.0 -54.38 35.26 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.123 0.569 . . . . 0.0 112.124 173.272 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 65.7 mt -55.31 -38.17 68.34 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.673 0.789 . . . . 0.0 111.051 178.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 60.1 ttp -63.43 -53.79 46.68 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.068 0.947 . . . . 0.0 112.014 177.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -69.71 -32.24 70.71 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.009 -1.057 . . . . 0.0 113.258 -178.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -61.56 -45.13 95.43 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.679 1.192 . . . . 0.0 110.932 169.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -61.81 -45.08 95.4 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.155 -0.965 . . . . 0.0 111.639 174.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 71.1 mt -61.66 -38.41 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.173 0.989 . . . . 0.0 112.076 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -58.11 -54.74 43.49 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.373 1.469 . . . . 0.0 111.471 173.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -86.01 1.23 51.03 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 120.122 -1.611 . . . . 0.0 113.04 -174.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt . . . . . 0 N--CA 1.474 0.744 0 C-N-CA 124.22 1.008 . . . . 0.0 110.424 173.57 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.3 t . . . . . 0 N--CA 1.477 0.888 0 CA-C-O 121.601 0.715 . . . . 0.0 112.34 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -68.71 168.64 12.81 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.039 1.336 . . . . 0.0 114.205 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.1 p -84.68 162.59 19.64 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.369 1.468 . . . . 0.0 114.032 176.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.3 p -145.28 140.63 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 125.254 1.422 . . . . 0.0 111.122 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -80.96 174.65 11.41 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.459 1.904 . . . . 0.0 111.881 175.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.94 -6.94 0.64 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.71 2.004 . . . . 0.0 115.791 -177.084 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 26.9 m -156.87 59.34 0.53 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.56 1.944 . . . . 0.0 110.758 169.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.11 -115.98 4.22 Favored Glycine 0 C--N 1.341 0.85 0 O-C-N 121.18 -0.95 . . . . 0.0 111.482 178.022 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 128' ' ' ALA . 28.5 m-20 52.36 -177.03 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.748 1.619 . . . . 0.0 113.006 -174.762 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 87' ' ' LEU . 1.4 mt -114.6 119.46 36.84 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 120.342 -1.474 . . . . 0.0 109.777 167.32 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.8 mt -85.04 149.19 25.75 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.632 0.773 . . . . 0.0 110.246 172.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 15.0 mt -81.77 112.45 19.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 123.525 0.73 . . . . 0.0 110.137 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 6.4 t -155.0 176.51 12.44 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.3 1.04 . . . . 0.0 112.202 169.274 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -68.31 -15.15 63.46 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -165.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.17 -32.41 73.79 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.751 1.159 . . . . 0.0 112.234 -177.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.7 mt -63.51 -36.47 76.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.384 0.673 . . . . 0.0 111.743 -170.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -59.67 -52.02 67.29 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.619 -0.676 . . . . 0.0 110.494 170.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -62.43 -30.63 71.37 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.32 1.048 . . . . 0.0 112.296 -179.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -53.51 56.39 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.087 0.955 . . . . 0.0 111.759 174.067 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -65.62 -43.23 90.19 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.373 176.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -40.06 89.7 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.338 0.972 . . . . 0.0 112.167 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.92 -38.18 84.86 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.51 -0.744 . . . . 0.0 112.586 -178.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -93.28 -21.11 19.79 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 32.1 mt -66.35 -23.35 66.33 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.58 1.082 . . . . 0.0 113.489 173.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 41.6 t . . . . . 0 N--CA 1.473 0.693 0 O-C-N 121.719 -0.613 . . . . 0.0 112.44 164.833 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 . . . . . 0 CA--C 1.529 0.143 0 N-CA-C 110.43 -0.211 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -65.97 -37.45 86.02 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.625 174.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.5 tt -60.74 -65.03 0.75 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.377 0.989 . . . . 0.0 111.018 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.85 -27.61 69.29 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.42 1.088 . . . . 0.0 112.896 -176.174 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -75.25 -40.27 59.08 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -41.81 95.62 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 174.762 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 7.4 mt -62.08 -40.39 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.466 -0.771 . . . . 0.0 112.104 172.634 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.89 -28.0 64.22 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -77.84 -26.29 49.31 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.115 0.966 . . . . 0.0 113.55 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -107.71 -52.88 2.7 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.123 1.369 . . . . 0.0 114.176 -172.136 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -82.95 130.99 35.2 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.582 -1.324 . . . . 0.0 110.347 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -59.61 -77.27 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 114.287 -1.324 . . . . 0.0 112.881 -158.418 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -155.47 -61.27 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 125.021 1.328 . . . . 0.0 110.23 174.111 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -68.52 -37.67 12.51 Favored 'Trans proline' 0 C--N 1.352 0.752 0 CA-C-N 121.501 1.572 . . . . 0.0 110.485 172.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 86' ' ' ASN . . . -52.56 -44.29 65.77 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.145 0.978 . . . . 0.0 111.445 171.521 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -60.5 -51.47 69.31 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.608 1.963 . . . . 0.0 111.309 178.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -60.69 -30.1 71.58 Favored Glycine 0 CA--C 1.526 0.778 0 C-N-CA 125.387 1.47 . . . . 0.0 114.02 177.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -77.29 -33.7 55.72 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.565 1.183 . . . . 0.0 111.09 172.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.99 -46.15 68.79 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.343 -0.848 . . . . 0.0 111.045 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -69.04 -34.13 74.71 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 176.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.45 -53.16 56.46 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.251 0.621 . . . . 0.0 111.901 172.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.4 mt -55.57 -34.35 64.69 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.074 0.949 . . . . 0.0 111.413 175.042 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 36.9 ttp -65.86 -53.41 40.19 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 118.634 0.652 . . . . 0.0 112.12 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -59.72 -44.73 93.6 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.701 -0.624 . . . . 0.0 112.56 176.074 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -62.23 -45.22 94.32 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.45 1.1 . . . . 0.0 111.389 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -58.62 -46.32 87.3 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.886 -0.509 . . . . 0.0 111.3 174.235 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 68.3 mt -61.76 -46.79 95.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 123.741 0.816 . . . . 0.0 111.32 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -65.62 -34.4 78.14 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.948 1.299 . . . . 0.0 112.252 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -91.75 -3.77 55.8 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 176.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt . . . . . 0 N--CA 1.476 0.861 0 O-C-N 120.995 -1.066 . . . . 0.0 113.115 -171.97 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.0 t . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -64.28 158.92 22.05 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.954 1.702 . . . . 0.0 113.915 -175.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.3 p -116.42 165.48 13.17 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -170.239 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.4 p -140.32 131.84 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 126.702 2.001 . . . . 0.0 111.145 -165.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -81.92 174.21 11.49 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.17 0.988 . . . . 0.0 112.069 172.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.71 -7.95 0.34 Allowed 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 117.136 2.273 . . . . 0.0 117.136 -171.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.4 t -145.84 48.64 1.23 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.716 1.207 . . . . 0.0 111.729 171.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.58 -121.83 5.55 Favored Glycine 0 CA--C 1.528 0.856 0 O-C-N 120.626 -1.296 . . . . 0.0 110.463 -174.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 57.9 -176.69 0.07 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.169 0.988 . . . . 0.0 111.32 -168.224 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -115.03 119.84 37.84 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.055 -1.028 . . . . 0.0 108.432 170.116 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.2 mt -84.2 135.73 34.25 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 119.156 0.889 . . . . 0.0 110.46 174.366 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 24.4 mt -66.14 102.14 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 124.265 1.026 . . . . 0.0 109.899 -174.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.6 p -142.46 156.67 45.19 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.228 1.811 . . . . 0.0 110.689 -175.422 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 30.0 ttt180 -66.38 -21.66 66.23 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -159.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -51.65 -45.73 63.45 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.54 1.536 . . . . 0.0 113.281 -174.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.0 pt -60.32 -28.31 41.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -177.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.3 ttt85 -65.03 -48.42 73.92 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.056 0.844 . . . . 0.0 110.941 173.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -69.88 -33.88 72.82 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.651 0.38 . . . . 0.0 111.885 -179.22 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.7 mp -56.64 -54.42 46.2 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 118.29 0.496 . . . . 0.0 112.026 171.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -64.46 -39.11 93.2 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.89 -30.82 62.82 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.752 1.16 . . . . 0.0 112.909 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.03 -30.77 71.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 175.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -91.0 -12.43 35.88 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 175.478 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.9 mt -80.32 -38.89 29.74 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 171.204 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.6 m . . . . . 0 N--CA 1.448 -0.538 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 178.604 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 t70 . . . . . 0 CA--C 1.543 0.675 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 115' ' ' ARG . 0.7 OUTLIER -76.72 -20.26 56.75 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 119.766 -1.834 . . . . 0.0 111.879 175.099 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.28 -58.0 7.81 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.777 0.431 . . . . 0.0 110.404 171.454 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -63.42 -32.35 73.76 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 121.169 -0.957 . . . . 0.0 112.744 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.45 -43.29 94.72 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.924 0.89 . . . . 0.0 112.436 176.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.52 -42.01 87.93 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.54 -0.725 . . . . 0.0 110.883 174.6 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 18.1 mt -56.77 -42.18 76.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 121.715 -0.615 . . . . 0.0 111.483 172.425 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -66.9 -19.74 65.78 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.73 -9.03 48.19 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.163 1.385 . . . . 0.0 114.652 171.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -125.42 -37.64 2.35 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -173.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -91.22 143.56 26.53 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.854 1.661 . . . . 0.0 110.236 174.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -64.8 -76.09 0.08 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -155.109 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -158.12 -58.52 0.02 OUTLIER Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 125.197 1.399 . . . . 0.0 109.812 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.3 -41.09 5.19 Favored 'Trans proline' 0 C--N 1.356 0.925 0 CA-C-N 121.411 1.539 . . . . 0.0 111.241 169.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.06 -41.7 65.08 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 120.765 -1.209 . . . . 0.0 112.536 175.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -60.15 -49.66 76.76 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.566 1.546 . . . . 0.0 110.915 173.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.86 -34.26 70.88 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 125.001 1.286 . . . . 0.0 114.196 175.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.11 -33.38 65.53 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.901 1.35 . . . . 0.0 110.201 175.356 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.73 -43.16 56.44 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.298 -0.876 . . . . 0.0 111.811 -174.24 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -68.36 -35.74 78.19 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 119.137 -0.458 . . . . 0.0 112.223 174.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.18 -50.21 74.06 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.643 0.656 . . . . 0.0 111.523 172.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.7 mp -56.39 -34.97 67.23 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.268 1.027 . . . . 0.0 112.149 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 3.3 tpt -65.09 -47.01 78.74 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.039 0.836 . . . . 0.0 111.74 177.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -67.06 -42.35 84.91 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.723 -0.611 . . . . 0.0 111.881 176.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -38.93 93.06 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.129 1.372 . . . . 0.0 112.371 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -63.81 -33.75 76.37 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.625 -1.297 . . . . 0.0 112.117 174.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 81.9 mt -77.04 -36.41 24.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.821 1.248 . . . . 0.0 111.589 175.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.599 ' O ' ' OD1' ' A' ' 141' ' ' ASP . 34.0 t0 -68.57 -30.28 69.02 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 120.869 -1.144 . . . . 0.0 110.365 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -96.99 10.03 40.35 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 173.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? . . . . . 0 N--CA 1.481 1.092 0 O-C-N 120.382 -1.449 . . . . 0.0 113.094 177.371 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.407 ' N ' ' OD2' ' A' ' 92' ' ' ASP . 4.8 t . . . . . 0 CA--C 1.541 0.625 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -62.75 153.45 32.75 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.92 0.888 . . . . 0.0 111.652 173.356 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.8 p -118.4 159.57 23.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.917 0.865 . . . . 0.0 112.272 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.7 t -118.31 124.8 73.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 C-N-CA 126.446 1.898 . . . . 0.0 107.43 -172.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -79.08 -177.22 5.5 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.116 1.366 . . . . 0.0 110.605 176.474 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.29 -21.26 5.26 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -174.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.33 52.86 1.27 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.242 1.017 . . . . 0.0 112.333 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.75 -120.24 5.18 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 120.674 -1.266 . . . . 0.0 111.722 -170.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 m120 60.18 171.57 0.09 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.505 1.122 . . . . 0.0 113.42 -173.262 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.35 111.88 23.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.379 -0.826 . . . . 0.0 109.949 172.366 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.5 mt -79.48 153.46 29.59 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 122.964 1.364 . . . . 0.0 112.769 176.035 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 18.2 mt -57.62 118.69 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.592 1.157 . . . . 0.0 110.338 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.9 p -146.93 130.39 16.75 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.983 0.913 . . . . 0.0 112.068 177.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -69.65 -14.21 62.7 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 120.868 -1.145 . . . . 0.0 113.223 -176.415 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.407 ' OD2' ' N ' ' A' ' 78' ' ' SER . 55.6 t0 -76.33 -15.75 59.9 Favored 'General case' 0 N--CA 1.455 -0.197 0 O-C-N 121.14 -0.975 . . . . 0.0 111.985 -177.036 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.3 -39.51 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.513 0.725 . . . . 0.0 112.4 174.3 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -64.14 -40.53 96.37 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 120.752 -1.217 . . . . 0.0 112.444 178.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -67.33 -30.4 70.21 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.372 1.069 . . . . 0.0 111.516 178.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -51.93 67.92 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.247 1.019 . . . . 0.0 111.605 172.573 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -67.34 -39.92 85.82 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.743 -0.646 . . . . 0.0 111.241 179.575 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.58 -45.46 93.88 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.13 0.972 . . . . 0.0 112.795 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.34 69.29 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -99.62 -14.84 18.8 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.966 0.906 . . . . 0.0 112.702 174.607 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.4 mt -70.98 -43.86 67.18 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.454 1.102 . . . . 0.0 112.442 171.284 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.485 1.297 0 CA-C-N 120.553 1.524 . . . . 0.0 112.081 172.861 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.468 0.461 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -67.82 -30.48 69.89 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 173.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.55 -63.92 1.04 Allowed 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.572 1.149 . . . . 0.0 111.751 -174.048 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -23.79 62.02 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 117.819 -1.086 . . . . 0.0 113.605 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.98 -50.33 66.78 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.519 0.728 . . . . 0.0 111.742 170.073 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.93 -47.7 84.1 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.895 0.771 . . . . 0.0 111.459 172.536 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 60.9 mt -56.32 -44.85 80.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.987 0.812 . . . . 0.0 110.836 179.123 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -76.19 -18.35 59.11 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -86.46 -6.26 58.95 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 173.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.485 ' OE2' ' HA ' ' A' ' 123' ' ' GLU . 27.9 mm-40 -128.49 -37.33 1.81 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -174.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.5 mp -80.69 162.14 24.29 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.137 0.494 . . . . 0.0 110.378 166.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -82.9 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.188 0 CA-C-O 121.921 0.867 . . . . 0.0 113.195 -174.364 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -164.98 -61.41 0.01 OUTLIER Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.443 1.497 . . . . 0.0 109.528 -178.598 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.1 -42.95 26.58 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.286 1.324 . . . . 0.0 110.906 173.157 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.5 -40.74 75.48 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.273 1.029 . . . . 0.0 112.724 177.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -60.76 -41.7 96.0 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.235 1.014 . . . . 0.0 110.568 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -56.58 -39.9 86.31 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 124.421 1.01 . . . . 0.0 113.909 174.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -72.03 -38.44 69.56 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.08 0.94 . . . . 0.0 112.972 171.643 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.62 -50.17 73.66 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 121.352 1.887 . . . . 0.0 112.578 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.1 pp -66.58 -33.57 75.96 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 176.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.39 -50.81 70.04 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.341 -0.849 . . . . 0.0 112.02 171.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 83.2 mt -58.45 -30.78 67.21 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.441 1.019 . . . . 0.0 111.726 176.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 7.6 ttp -63.62 -64.34 0.92 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.225 1.41 . . . . 0.0 111.963 172.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -64.14 -29.32 70.45 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.872 -1.142 . . . . 0.0 112.44 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.84 -46.62 87.07 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.457 1.903 . . . . 0.0 113.269 171.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' TYR . . . . . 0.541 ' C ' ' CD1' ' A' ' 139' ' ' TYR . 0.5 OUTLIER -75.88 -22.28 56.32 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 118.145 -1.422 . . . . 0.0 109.873 -177.367 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 69.1 mt -71.58 -45.13 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.023 171.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -58.55 -45.23 89.37 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.482 1.513 . . . . 0.0 110.395 175.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -93.67 15.65 15.78 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.291 1.037 . . . . 0.0 113.588 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? . . . . . 0 N--CA 1.487 1.406 0 O-C-N 120.271 -1.518 . . . . 0.0 111.476 -178.953 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 121.147 0.499 . . . . 0.0 111.59 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -56.27 148.74 17.79 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.299 1.04 . . . . 0.0 112.524 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.6 p -125.32 161.2 27.52 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.716 1.246 . . . . 0.0 113.476 -170.049 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.5 m -138.46 149.11 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 126.103 1.761 . . . . 0.0 109.838 -175.134 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -79.5 177.98 8.46 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 124.354 1.061 . . . . 0.0 111.843 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.19 13.1 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 128.32 2.648 . . . . 0.0 116.767 -177.055 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.8 m -156.92 30.43 0.31 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.661 1.984 . . . . 0.0 111.355 169.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.1 -127.48 8.69 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 120.557 -1.339 . . . . 0.0 112.219 -173.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 57.09 -170.34 0.1 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.426 1.09 . . . . 0.0 112.282 -167.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.35 116.53 26.39 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.438 -0.789 . . . . 0.0 109.823 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mt -88.64 158.02 18.37 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 123.032 1.396 . . . . 0.0 112.884 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 14.2 mt -80.2 95.11 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 124.462 1.105 . . . . 0.0 110.065 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . 0.256 8.1 t -119.45 3.92 11.22 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.006 1.323 . . . . 0.0 113.731 174.398 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 15.2 ttm105 65.94 -17.75 0.11 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 126.19 1.796 . . . . 0.0 115.42 -177.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -43.01 -47.02 5.71 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.862 1.665 . . . . 0.0 114.814 176.633 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 48.9 pt -57.18 -27.72 28.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -176.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -70.2 -48.78 55.64 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.158 0.89 . . . . 0.0 110.977 175.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -60.66 -34.4 74.26 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.38 0.672 . . . . 0.0 111.382 173.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 tt -64.09 -49.21 73.16 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.256 1.022 . . . . 0.0 111.864 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -62.8 -44.28 96.58 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.231 0.923 . . . . 0.0 112.711 171.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.11 -42.03 76.18 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.685 1.13 . . . . 0.0 112.308 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.28 -46.25 91.1 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.455 -0.778 . . . . 0.0 112.367 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -78.63 -21.38 48.51 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.7 mt -73.02 -48.33 37.19 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 118.731 0.696 . . . . 0.0 112.145 170.044 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 13.5 t . . . . . 0 N--CA 1.476 0.835 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -174.091 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 38.1 t70 . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 121.689 0.757 . . . . 0.0 111.544 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.84 -43.01 63.16 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.887 1.275 . . . . 0.0 111.907 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 52.4 tp -57.11 -53.36 58.96 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.459 1.104 . . . . 0.0 111.94 178.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -62.88 -30.13 71.29 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.504 -0.748 . . . . 0.0 112.567 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.94 -40.46 63.06 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.211 1.004 . . . . 0.0 111.617 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.0 -39.39 79.36 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.387 0.675 . . . . 0.0 111.066 175.402 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 17.0 mt -61.62 -43.32 96.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 O-C-N 121.302 -0.874 . . . . 0.0 111.175 172.284 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.65 -25.17 63.79 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -80.91 -36.87 30.57 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 174.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -93.98 -34.35 13.09 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -175.57 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 27.5 mt -81.28 170.95 15.43 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.448 1.022 . . . . 0.0 112.41 173.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.96 -78.18 0.2 Allowed 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.693 -0.63 . . . . 0.0 112.101 -167.439 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -162.05 -63.37 0.02 OUTLIER Pre-proline 0 CA--C 1.543 0.683 0 C-N-CA 125.581 1.553 . . . . 0.0 109.291 174.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -64.52 -37.19 39.39 Favored 'Trans proline' 0 C--N 1.356 0.922 0 CA-C-N 121.156 1.449 . . . . 0.0 111.126 174.164 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.27 -41.18 62.64 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.403 1.081 . . . . 0.0 112.889 172.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 8.6 ttt180 -63.39 -49.18 74.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.372 1.069 . . . . 0.0 110.587 175.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.71 -31.77 72.3 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.564 1.078 . . . . 0.0 113.894 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -77.22 -32.97 56.25 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.511 1.155 . . . . 0.0 110.95 173.128 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.22 -46.59 60.85 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.483 -0.761 . . . . 0.0 110.958 -175.549 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -66.31 -37.96 86.61 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.133 0.573 . . . . 0.0 112.45 174.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.24 -53.58 55.02 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.85 0.75 . . . . 0.0 111.711 176.19 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 93.0 mt -59.66 -32.51 70.54 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 118.364 -0.827 . . . . 0.0 111.405 177.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 45.9 ttp -66.66 -51.63 53.95 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.558 0.743 . . . . 0.0 112.652 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -65.68 -40.16 92.06 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.302 -0.874 . . . . 0.0 111.763 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -61.63 -44.4 97.06 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.605 1.162 . . . . 0.0 111.475 174.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -60.18 -47.08 87.46 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.646 -0.659 . . . . 0.0 111.317 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 65.1 mt -59.98 -39.68 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.623 0.769 . . . . 0.0 111.198 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -61.66 -43.23 99.26 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -92.09 6.57 46.0 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? . . . . . 0 N--CA 1.478 0.958 0 C-N-CA 125.262 1.425 . . . . 0.0 112.743 174.12 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 7.9 t-160 . . . . . 0 CA--C 1.55 0.965 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 90.0 mt -137.01 80.25 36.12 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.541 1.536 . . . . 0.0 111.127 176.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -73.22 168.44 24.74 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.221 3.28 . . . . 0.0 113.209 174.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 80.7 p -88.1 175.82 7.56 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.34 1.456 . . . . 0.0 114.356 -174.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.4 p -60.2 149.06 34.19 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -77.1 -6.02 51.22 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.953 1.464 . . . . 0.0 114.953 -174.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.56 -38.7 0.4 Allowed 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 -169.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 70.04 5.95 54.87 Favored Glycine 0 CA--C 1.54 1.639 0 N-CA-C 116.054 1.182 . . . . 0.0 116.054 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.2 p -63.22 -29.45 70.78 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 119.282 1.541 . . . . 0.0 113.357 178.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.2 t -156.09 -175.64 5.54 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.97 1.708 . . . . 0.0 110.264 -173.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.1 m -105.35 165.51 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.969 1.307 . . . . 0.0 112.109 176.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 -121.34 80.88 1.72 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.707 2.003 . . . . 0.0 108.3 175.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 132.24 76.16 0.12 Allowed Glycine 0 N--CA 1.47 0.95 0 C-N-CA 123.835 0.731 . . . . 0.0 113.526 -179.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.5 ' H ' ' CG ' ' A' ' 92' ' ' ASP . 1.7 t -145.52 20.54 1.51 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.601 2.36 . . . . 0.0 112.081 173.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -59.19 161.88 4.98 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.606 1.963 . . . . 0.0 112.369 172.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.9 p -114.27 165.66 12.45 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.3 1.048 . . . . 0.0 113.648 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.2 p -128.83 130.84 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 126.931 2.093 . . . . 0.0 109.961 -172.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -77.99 173.7 11.9 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.519 1.128 . . . . 0.0 111.477 174.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.01 3.96 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 127.617 2.367 . . . . 0.0 116.403 -173.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 15.2 m -152.55 30.41 0.53 Allowed 'General case' 0 N--CA 1.471 0.591 0 O-C-N 119.896 -1.753 . . . . 0.0 112.517 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 92.09 -128.17 9.26 Favored Glycine 0 CA--C 1.528 0.901 0 O-C-N 120.631 -1.293 . . . . 0.0 110.51 -167.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 57.08 172.74 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.821 1.248 . . . . 0.0 112.989 -169.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.3 122.16 43.19 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 120.977 -1.077 . . . . 0.0 109.321 172.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.7 mt -88.37 143.89 26.73 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 120.223 1.374 . . . . 0.0 111.622 173.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.5 mt -63.4 109.82 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.931 1.292 . . . . 0.0 110.037 -176.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 p -149.37 143.29 25.67 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.302 1.441 . . . . 0.0 110.847 -173.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 32.5 ttt-85 -71.65 -13.57 61.79 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -175.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.5 ' CG ' ' H ' ' A' ' 78' ' ' SER . 32.4 t70 -51.98 -40.47 60.99 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.699 1.2 . . . . 0.0 112.294 171.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 67.1 mt -54.55 -33.95 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.158 0.983 . . . . 0.0 111.572 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 40.1 ttt85 -83.38 -32.4 26.22 Favored 'General case' 0 N--CA 1.456 -0.144 0 O-C-N 120.941 -1.099 . . . . 0.0 111.686 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -61.98 -35.06 77.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.472 -0.142 . . . . 0.0 111.189 170.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.4 -52.84 56.17 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.144 1.378 . . . . 0.0 111.641 177.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -61.74 -46.0 91.53 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.652 -0.655 . . . . 0.0 112.322 172.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -59.77 -41.42 91.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.305 0.957 . . . . 0.0 112.346 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.92 -43.66 98.39 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.695 -0.628 . . . . 0.0 111.608 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -85.66 -12.88 50.19 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.4 mt -73.22 -40.05 65.01 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.635 1.107 . . . . 0.0 111.97 170.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.9 m -78.63 -36.82 43.51 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 171.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -78.58 8.21 5.6 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 173.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 4.2 p -61.78 -32.7 54.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -166.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 74.72 126.49 0.16 Allowed Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.323 0.963 . . . . 0.0 112.886 -174.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.96 -59.81 2.53 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.713 -0.875 . . . . 0.0 111.359 176.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -78.51 -47.68 1.9 Allowed Pre-proline 0 CA--C 1.551 0.991 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 177.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -79.49 16.99 1.31 Allowed 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.819 3.013 . . . . 0.0 114.645 -178.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 45.7 tp -41.69 -39.61 1.73 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 127.976 2.51 . . . . 0.0 115.534 -172.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -63.03 -31.02 72.07 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -178.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -82.86 -42.07 18.23 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 118.91 0.777 . . . . 0.0 111.871 -178.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.1 m -58.19 -43.08 87.36 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.173 0.989 . . . . 0.0 112.045 -176.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.1 pp -67.6 -33.32 74.77 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 122.949 0.499 . . . . 0.0 111.959 176.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -72.17 -38.0 69.23 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.346 0.658 . . . . 0.0 111.269 -176.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -70.09 -43.85 70.24 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.207 -0.933 . . . . 0.0 111.929 169.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 54.5 tp -51.13 -61.62 2.12 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.677 0.791 . . . . 0.0 111.44 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.8 ppt_? -60.13 -28.24 67.72 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.847 0.859 . . . . 0.0 112.763 -178.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.76 -41.82 74.67 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 173.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -59.79 -47.84 84.08 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.096 0.862 . . . . 0.0 112.163 176.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.1 mp -60.1 -42.66 90.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 118.517 0.599 . . . . 0.0 111.088 176.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.54 -23.49 65.44 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.42 -50.55 5.89 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.71 0.804 . . . . 0.0 112.735 174.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -76.94 -38.48 53.27 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.416 -1.427 . . . . 0.0 113.206 -170.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.475 HD12 ' HB1' ' A' ' 128' ' ' ALA . 3.3 mm? -68.66 -172.33 0.35 Allowed 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 120.199 1.363 . . . . 0.0 111.567 171.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -97.5 -120.34 0.13 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.632 1.173 . . . . 0.0 110.109 169.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.484 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 20.5 tt0 -120.26 -63.86 0.03 OUTLIER Pre-proline 0 CA--C 1.536 0.423 0 C-N-CA 125.699 1.6 . . . . 0.0 108.448 -172.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.484 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.9 Cg_endo -67.22 -36.3 21.76 Favored 'Trans proline' 0 C--N 1.351 0.675 0 CA-C-N 120.641 1.265 . . . . 0.0 111.307 174.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.475 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -59.74 -34.25 72.71 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 120.833 -1.167 . . . . 0.0 112.477 176.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 19.0 ttt180 -63.09 -48.77 77.17 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.279 1.031 . . . . 0.0 110.434 172.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.14 -34.57 80.21 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 124.729 1.157 . . . . 0.0 113.514 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -75.25 -33.04 61.26 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 118.38 1.09 . . . . 0.0 111.171 174.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.03 -44.93 62.61 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.212 0.605 . . . . 0.0 111.132 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.35 -37.05 80.12 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.252 0.621 . . . . 0.0 112.365 174.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.22 -55.49 24.54 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 118.387 0.54 . . . . 0.0 111.696 175.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.8 mp -56.9 -30.47 63.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.2 175.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 9.3 tmm? -67.34 -52.05 44.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.215 0.916 . . . . 0.0 111.673 176.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -67.37 -38.33 84.6 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.45 -0.781 . . . . 0.0 112.583 177.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.11 -34.96 73.77 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.529 1.532 . . . . 0.0 112.224 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -63.13 -46.94 84.9 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.115 -0.99 . . . . 0.0 110.3 168.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 78.2 mt -60.58 -34.94 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.588 0.755 . . . . 0.0 112.269 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.468 ' O ' ' OD1' ' A' ' 141' ' ' ASP . 48.4 t0 -67.37 -25.3 65.9 Favored 'General case' 0 C--N 1.34 0.177 0 C-N-CA 124.101 0.96 . . . . 0.0 111.63 -177.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -113.21 5.81 17.16 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? -74.64 -25.9 59.52 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.675 -1.265 . . . . 0.0 112.94 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -88.02 135.39 33.44 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.527 1.931 . . . . 0.0 110.829 174.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -79.31 43.67 0.55 Allowed 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 -178.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 CA--C 1.549 0.907 0 C-N-CA 125.79 1.636 . . . . 0.0 113.489 171.956 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 . . . . . 0 CA--C 1.549 0.929 0 CA-C-O 121.622 0.725 . . . . 0.0 112.132 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 73.9 mt -64.21 149.2 94.7 Favored Pre-proline 0 CA--C 1.543 0.71 0 C-N-CA 124.556 1.143 . . . . 0.0 111.696 175.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -63.61 148.97 92.03 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 122.685 2.257 . . . . 0.0 112.658 176.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.0 p -77.81 -176.4 4.4 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.501 1.92 . . . . 0.0 113.44 -174.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.3 p -74.33 -163.73 0.21 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.643 0.777 . . . . 0.0 111.853 164.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -59.8 160.19 7.88 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.754 1.621 . . . . 0.0 113.902 -176.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 6.4 mtp180 -63.54 130.07 42.83 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 121.129 -0.982 . . . . 0.0 111.832 178.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 129.99 -150.43 19.09 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.61 1.1 . . . . 0.0 111.506 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.9 t -73.27 -178.52 2.97 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.398 0.679 . . . . 0.0 111.861 171.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 50.8 m -63.78 166.66 6.86 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.99 1.316 . . . . 0.0 113.429 177.206 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.3 m -56.09 134.07 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.77 0.828 . . . . 0.0 111.205 175.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -82.92 50.65 1.76 Allowed 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -168.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.24 119.76 16.28 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 123.744 0.687 . . . . 0.0 112.989 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.47 ' H ' ' CG ' ' A' ' 92' ' ' ASP . 2.9 t -142.81 28.16 1.6 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.693 1.997 . . . . 0.0 112.045 -175.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -68.8 165.75 19.04 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.44 -1.413 . . . . 0.0 111.043 165.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.5 p -134.43 160.33 38.33 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.729 0.776 . . . . 0.0 112.335 175.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.4 t -122.76 128.13 75.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 125.927 1.691 . . . . 0.0 108.193 -169.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -81.84 177.1 9.07 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.561 1.144 . . . . 0.0 112.726 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.93 -19.15 1.63 Allowed 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -170.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.5 m -134.69 29.93 3.48 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.039 1.336 . . . . 0.0 112.434 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 96.21 -123.12 7.59 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -171.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 50.1 m-20 59.22 178.62 0.08 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.66 1.184 . . . . 0.0 114.067 -176.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.12 127.37 54.11 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.369 -0.832 . . . . 0.0 109.114 168.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.8 mt -93.22 149.75 21.0 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 122.117 0.961 . . . . 0.0 110.957 168.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 16.7 mt -79.75 99.74 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 O-C-N 121.447 -0.783 . . . . 0.0 110.625 -173.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 30.1 p -118.28 -1.48 11.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.254 1.022 . . . . 0.0 113.398 170.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 64.95 -0.31 1.05 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.152 1.781 . . . . 0.0 115.389 -175.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.47 ' CG ' ' H ' ' A' ' 78' ' ' SER . 29.5 t70 -50.06 -49.5 51.05 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.843 1.657 . . . . 0.0 114.718 178.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.2 pt -52.6 -25.86 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 N-CA-C 113.72 1.008 . . . . 0.0 113.72 -176.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -61.66 -45.59 93.36 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.672 1.124 . . . . 0.0 112.145 171.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -58.29 -40.71 82.67 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.054 0.843 . . . . 0.0 111.637 173.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.47 -39.65 85.29 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.554 0.742 . . . . 0.0 111.983 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -70.88 -43.63 67.99 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.092 0.86 . . . . 0.0 112.603 171.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -59.14 -36.84 75.96 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.4 1.08 . . . . 0.0 112.234 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.89 -24.17 67.45 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 175.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -111.04 -11.78 14.26 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.429 1.092 . . . . 0.0 113.641 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.4 mt -75.93 -33.82 59.87 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.302 1.041 . . . . 0.0 111.008 167.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.4 p -74.97 -42.15 58.17 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.553 1.141 . . . . 0.0 112.13 170.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -90.84 26.22 2.14 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.199 1.4 . . . . 0.0 114.233 176.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 8.7 p -56.81 -29.35 30.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -165.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 133.89 119.75 2.02 Favored Glycine 0 N--CA 1.468 0.785 0 O-C-N 121.185 -0.947 . . . . 0.0 113.077 169.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -69.34 -33.62 73.39 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 114.109 1.151 . . . . 0.0 114.109 -178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.468 ' H ' ' HD2' ' A' ' 108' ' ' PRO . 43.6 mt-10 -146.32 -54.44 0.02 OUTLIER Pre-proline 0 N--CA 1.478 0.974 0 C-N-CA 126.164 1.785 . . . . 0.0 112.722 179.212 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.468 ' HD2' ' H ' ' A' ' 107' ' ' GLU . 66.7 Cg_endo -79.65 58.6 7.04 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 123.644 2.896 . . . . 0.0 112.821 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.39 -42.02 61.11 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.43 1.492 . . . . 0.0 112.12 -177.544 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 67.3 mm-40 -60.83 -20.59 61.98 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.742 1.217 . . . . 0.0 113.71 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -96.08 -24.39 16.34 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.609 1.164 . . . . 0.0 113.353 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.1 m -61.27 -49.32 77.53 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.538 -1.351 . . . . 0.0 110.43 167.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.3 pp -68.39 -31.15 70.3 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 118.355 -0.831 . . . . 0.0 112.761 -177.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.2 -49.27 78.31 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.407 0.683 . . . . 0.0 110.939 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 85.2 mtm180 -65.37 -46.62 79.42 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.475 1.11 . . . . 0.0 111.007 176.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.1 tt -51.05 -64.01 0.95 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.626 1.17 . . . . 0.0 111.4 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -32.48 68.54 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.561 1.144 . . . . 0.0 112.809 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.87 87.38 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.904 -0.569 . . . . 0.0 112.127 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -60.79 -47.85 84.45 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.781 0.719 . . . . 0.0 112.116 176.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.3 mp -63.15 -45.03 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.155 0.889 . . . . 0.0 111.348 176.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.79 -29.74 69.01 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -179.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.67 -65.83 0.74 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.812 0.845 . . . . 0.0 110.899 172.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -70.72 -46.08 63.73 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.304 1.441 . . . . 0.0 113.403 -169.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 6.8 mp -78.58 164.13 24.93 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 120.727 -1.233 . . . . 0.0 109.809 168.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -79.09 -93.47 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.499 0.72 . . . . 0.0 112.329 -165.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.465 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 47.0 tt0 -146.92 -54.6 0.02 OUTLIER Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 124.962 1.305 . . . . 0.0 111.198 175.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.465 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 64.2 Cg_endo -70.84 -38.89 4.91 Favored 'Trans proline' 0 C--N 1.354 0.84 0 CA-C-N 121.449 1.553 . . . . 0.0 111.004 171.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.69 -42.08 64.46 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.221 1.408 . . . . 0.0 112.678 177.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -56.36 -49.29 74.82 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.766 2.026 . . . . 0.0 111.19 173.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.22 -34.38 67.13 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 125.151 1.357 . . . . 0.0 113.798 176.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -76.79 -31.19 56.83 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.457 1.128 . . . . 0.0 110.92 175.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.2 -50.98 50.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 122.87 0.468 . . . . 0.0 110.36 -178.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.7 pp -66.34 -35.77 81.21 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 177.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.65 -53.11 56.51 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.603 0.638 . . . . 0.0 112.019 174.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.67 -27.57 68.78 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 117.655 -1.164 . . . . 0.0 111.692 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -64.93 -53.09 51.86 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.866 1.212 . . . . 0.0 111.677 173.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -64.31 -41.45 96.84 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 177.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -68.41 -40.39 81.28 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.011 1.324 . . . . 0.0 112.671 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -58.19 -38.51 76.87 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.201 -0.937 . . . . 0.0 111.157 169.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 86.4 mt -71.23 -44.43 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 123.712 0.805 . . . . 0.0 112.387 177.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -54.44 -31.43 55.39 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.608 1.563 . . . . 0.0 111.466 174.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -106.34 3.93 28.06 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 178.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -72.44 -25.72 61.56 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 125.022 1.329 . . . . 0.0 112.875 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -98.75 135.92 39.53 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.969 0.908 . . . . 0.0 109.995 -177.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 24.0 pt-20 -72.59 28.13 0.06 Allowed 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.846 1.658 . . . . 0.0 114.553 178.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 50.1 mt . . . . . 0 CA--C 1.545 0.773 0 C-N-CA 130.115 3.366 . . . . 0.0 117.032 -177.266 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 9.7 m170 . . . . . 0 N--CA 1.468 0.464 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.9 tp 46.87 62.14 12.25 Favored Pre-proline 0 CA--C 1.558 1.277 0 C-N-CA 125.876 1.67 . . . . 0.0 113.786 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -62.79 130.88 30.92 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 122.583 2.189 . . . . 0.0 111.292 -178.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.2 p -141.27 107.02 5.11 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.433 1.493 . . . . 0.0 110.554 -163.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 59.0 p -135.7 39.95 2.79 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -169.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 30.3 p90 -68.82 22.0 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 128.037 2.535 . . . . 0.0 116.38 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -70.77 170.35 12.64 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.575 1.55 . . . . 0.0 113.591 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 121.02 -177.5 16.38 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 125.476 1.513 . . . . 0.0 112.159 -174.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.5 t -68.37 148.43 50.71 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 122.149 -0.618 . . . . 0.0 110.619 166.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.4 t 57.27 62.88 2.04 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 -177.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 8.7 m -57.8 163.55 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.294 1.038 . . . . 0.0 112.561 171.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -30.93 -63.22 0.15 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.473 1.909 . . . . 0.0 115.723 178.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 117.16 140.55 6.7 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 122.939 1.3 . . . . 0.0 112.611 -173.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.9 t -78.95 92.11 4.9 Favored 'General case' 0 C--O 1.238 0.487 0 O-C-N 121.613 -0.934 . . . . 0.0 109.701 173.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -53.48 154.96 3.18 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.435 1.112 . . . . 0.0 111.711 175.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 5.9 p -114.2 157.88 22.09 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.204 1.402 . . . . 0.0 111.722 -175.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.5 t -129.48 128.23 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 125.505 1.522 . . . . 0.0 107.478 -172.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -81.54 -175.17 5.38 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.736 0.814 . . . . 0.0 111.293 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.39 -21.0 8.44 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -172.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -144.73 50.79 1.26 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.291 1.036 . . . . 0.0 112.334 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.07 -122.82 5.84 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 120.376 -1.452 . . . . 0.0 110.826 -169.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 m120 60.31 172.0 0.09 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.338 1.055 . . . . 0.0 112.964 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.59 119.14 38.65 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 170.29 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.62 143.52 38.17 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-O 121.568 0.699 . . . . 0.0 110.12 173.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 48.0 mm -73.23 108.33 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 O-C-N 121.56 -0.712 . . . . 0.0 109.932 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.2 p -152.32 158.24 42.47 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.991 1.316 . . . . 0.0 112.392 177.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -57.93 -14.23 5.9 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.488 1.515 . . . . 0.0 114.494 -174.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -66.15 -28.79 69.06 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 122.47 0.308 . . . . 0.0 111.7 -178.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.542 HG21 HD23 ' A' ' 135' ' ' LEU . 88.1 mt -62.51 -53.99 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 121.285 0.564 . . . . 0.0 111.662 178.312 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -72.28 -28.75 63.31 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 118.587 -0.72 . . . . 0.0 112.818 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -70.48 -40.11 73.81 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.75 174.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.07 -51.25 58.78 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.819 1.247 . . . . 0.0 111.606 170.224 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -66.0 -36.12 82.42 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.034 -1.041 . . . . 0.0 112.056 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.57 -48.13 80.81 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.982 1.264 . . . . 0.0 111.306 173.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.44 -35.32 75.54 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.99 0.916 . . . . 0.0 112.644 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -91.04 -17.09 26.83 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.9 mt -72.98 -34.95 66.77 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 120.605 -1.31 . . . . 0.0 113.019 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.6 t -82.22 -5.21 58.34 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.339 0.972 . . . . 0.0 113.096 175.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -83.13 -2.55 55.73 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 124.762 1.225 . . . . 0.0 114.242 173.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 3.8 p -88.63 -5.61 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -175.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -73.76 -7.26 74.49 Favored Glycine 0 CA--C 1.541 1.691 0 O-C-N 120.182 -1.573 . . . . 0.0 113.979 175.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -115.97 -60.17 1.9 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.177 1.791 . . . . 0.0 112.197 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.422 ' OE2' ' NH1' ' A' ' 115' ' ' ARG . 13.4 mt-10 -93.96 151.51 39.82 Favored Pre-proline 0 CA--C 1.542 0.655 0 N-CA-C 113.734 1.012 . . . . 0.0 113.734 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -68.86 150.63 73.74 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.764 2.309 . . . . 0.0 111.236 173.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -51.45 -37.54 49.29 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-N 115.11 -0.95 . . . . 0.0 113.293 -179.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -45.88 81.16 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 117.63 -1.176 . . . . 0.0 112.472 177.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -80.36 -37.94 31.43 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 120.358 1.436 . . . . 0.0 113.435 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.0 p -63.9 -40.53 96.73 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.221 0.919 . . . . 0.0 111.575 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.45 -36.72 76.88 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-O 117.783 -1.103 . . . . 0.0 111.962 173.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -55.67 -42.22 74.81 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.33 0.968 . . . . 0.0 110.524 -174.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.422 ' NH1' ' OE2' ' A' ' 107' ' ' GLU . 82.0 mtt180 -78.03 -41.29 36.17 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.767 0.827 . . . . 0.0 111.167 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 33.2 tp -55.99 -59.77 4.43 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.966 0.412 . . . . 0.0 111.994 177.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -24.83 64.44 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.349 -0.834 . . . . 0.0 113.002 -178.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.48 -51.27 53.34 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.864 0.756 . . . . 0.0 111.842 170.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -51.06 69.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.551 0.74 . . . . 0.0 110.812 173.372 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 62.1 mt -55.45 -43.7 73.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 O-C-N 121.7 -0.625 . . . . 0.0 111.461 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -77.8 -24.66 48.75 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -75.73 -42.54 50.41 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.606 0.763 . . . . 0.0 110.056 172.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -76.74 -61.13 2.07 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 124.598 1.159 . . . . 0.0 112.9 -178.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 57.5 mt -60.38 171.9 0.97 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.926 1.239 . . . . 0.0 112.221 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 10.8 tp-100 -71.48 -88.99 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.857 0.863 . . . . 0.0 111.936 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -166.13 -59.19 0.01 OUTLIER Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 125.645 1.578 . . . . 0.0 109.432 -172.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -63.2 -44.49 15.04 Favored 'Trans proline' 0 C--N 1.359 1.104 0 CA-C-N 120.357 1.163 . . . . 0.0 110.748 171.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.27 -37.54 75.17 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.435 1.094 . . . . 0.0 112.772 177.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 14.1 ttt180 -58.24 -47.24 84.15 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.484 0.714 . . . . 0.0 110.671 174.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -54.08 -45.47 72.45 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.299 0.952 . . . . 0.0 112.793 176.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.08 -37.19 83.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.01 0.905 . . . . 0.0 113.16 174.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.42 -50.01 61.26 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 120.627 1.558 . . . . 0.0 112.324 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.0 pp -65.45 -34.82 79.19 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.732 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.35 -48.38 75.75 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-O 119.054 -0.498 . . . . 0.0 111.301 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.542 HD23 HG21 ' A' ' 93' ' ' ILE . 6.0 mp -61.01 -28.07 68.77 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.349 -1.31 . . . . 0.0 111.471 175.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.39 -58.47 6.97 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 120.154 1.343 . . . . 0.0 111.851 172.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -66.75 -37.14 84.05 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.276 -0.89 . . . . 0.0 112.48 178.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.21 -45.02 90.1 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.154 1.382 . . . . 0.0 112.102 174.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -59.3 -42.26 90.93 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 118.876 -0.583 . . . . 0.0 110.609 171.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.99 -33.61 59.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-O 118.091 -0.957 . . . . 0.0 112.17 175.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -62.87 -44.04 97.18 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.398 0.999 . . . . 0.0 112.466 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -100.21 14.2 31.65 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 174.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 23.2 ttpt -66.09 -40.4 90.79 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 120.639 -1.288 . . . . 0.0 112.865 -175.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -72.73 -177.0 2.16 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.072 0.949 . . . . 0.0 108.882 171.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 58.19 28.8 17.04 Favored 'General case' 0 CA--C 1.552 1.045 0 O-C-N 120.604 -1.31 . . . . 0.0 114.298 175.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 9.6 mt . . . . . 0 CA--C 1.55 0.957 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 174.442 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 63.4 m170 . . . . . 0 CA--C 1.555 1.155 0 N-CA-C 115.422 1.638 . . . . 0.0 115.422 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 11.2 mp 69.1 152.48 0.13 Allowed Pre-proline 0 CA--C 1.553 1.077 0 C-N-CA 129.269 3.028 . . . . 0.0 114.437 -168.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -79.9 -22.62 7.37 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.286 2.657 . . . . 0.0 115.126 -170.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.5 p -121.68 155.96 34.06 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.139 1.375 . . . . 0.0 111.097 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.0 t -104.19 127.86 51.85 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.552 -0.718 . . . . 0.0 112.147 -176.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 43.2 p90 -85.92 20.58 2.18 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.635 1.974 . . . . 0.0 113.335 -177.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 44.6 ttp180 61.34 -27.38 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 128.861 2.864 . . . . 0.0 116.596 -177.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -73.67 72.71 1.24 Allowed Glycine 0 CA--C 1.531 1.05 0 C-N-CA 125.613 1.578 . . . . 0.0 114.261 -178.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.5 t -56.56 -23.71 42.13 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -176.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.9 t -157.35 163.51 38.55 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.238 1.415 . . . . 0.0 110.961 165.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 10.0 p -90.24 159.04 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 125.58 1.552 . . . . 0.0 111.934 178.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -134.59 29.23 3.57 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.698 -0.627 . . . . 0.0 112.128 -169.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -77.06 129.55 9.77 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 124.892 1.234 . . . . 0.0 114.389 179.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.0 t -126.54 24.44 6.67 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.643 1.977 . . . . 0.0 112.236 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -62.07 154.31 27.29 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.824 1.25 . . . . 0.0 114.262 -168.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.563 ' H ' HG21 ' A' ' 90' ' ' THR . 35.8 p -92.24 152.92 19.59 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.067 1.347 . . . . 0.0 112.956 177.315 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.3 t -122.89 137.27 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 126.052 1.741 . . . . 0.0 107.926 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -75.8 175.64 8.53 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.428 1.091 . . . . 0.0 111.794 176.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.7 -12.38 1.83 Allowed 'General case' 0 CA--C 1.553 1.09 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 -174.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.8 m -155.63 64.53 0.6 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.773 1.629 . . . . 0.0 110.536 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 73.6 -123.96 8.48 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 121.709 -0.619 . . . . 0.0 111.97 -174.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.406 ' O ' ' HB2' ' A' ' 128' ' ' ALA . 5.4 m120 55.31 -179.51 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.864 1.265 . . . . 0.0 112.733 -172.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -115.3 127.23 55.31 Favored 'General case' 0 N--CA 1.481 1.116 0 O-C-N 120.291 -1.506 . . . . 0.0 110.747 171.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.8 mt -96.23 154.66 17.13 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 122.709 1.243 . . . . 0.0 112.863 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 32.6 mm -78.48 93.57 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 124.555 1.142 . . . . 0.0 111.235 -175.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.563 HG21 ' H ' ' A' ' 80' ' ' SER 0.255 13.7 t -132.15 12.96 4.69 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -179.29 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 66.82 -19.27 0.11 Allowed 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 116.671 2.1 . . . . 0.0 116.671 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -42.62 -51.22 5.27 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 126.385 1.874 . . . . 0.0 114.828 178.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 21.6 pt -55.51 -31.29 27.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 94' ' ' ARG . 2.7 mtp85 -67.02 -43.77 81.98 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.164 -0.96 . . . . 0.0 111.527 175.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -69.51 -19.67 63.72 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.699 1.6 . . . . 0.0 112.919 176.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.86 -56.94 4.15 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.087 1.355 . . . . 0.0 111.246 167.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -59.82 -41.5 91.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.095 0.861 . . . . 0.0 112.89 -178.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -64.96 -37.68 88.46 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.875 0.761 . . . . 0.0 111.953 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.08 -30.44 70.35 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.415 0.895 . . . . 0.0 113.415 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -89.12 -38.23 14.48 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.793 0.837 . . . . 0.0 113.043 173.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.2 mt -59.02 -45.25 91.16 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.342 0.974 . . . . 0.0 111.041 176.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.3 m -74.35 5.64 4.39 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.105 1.362 . . . . 0.0 114.307 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -121.73 4.52 10.04 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.753 1.621 . . . . 0.0 115.005 -177.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 10.4 p -68.58 -36.72 75.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 114.873 1.435 . . . . 0.0 114.873 -170.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 52.29 -147.6 12.98 Favored Glycine 0 CA--C 1.544 1.882 0 N-CA-C 115.711 1.044 . . . . 0.0 115.711 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -96.39 8.98 42.66 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 122.43 -0.453 . . . . 0.0 110.807 175.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -70.61 153.98 94.64 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 123.562 0.745 . . . . 0.0 111.818 174.379 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.49 120.91 7.83 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.63 2.22 . . . . 0.0 111.172 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.0 mt -49.38 -32.08 10.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.901 1.28 . . . . 0.0 112.922 177.233 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -53.5 -37.45 62.76 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.79 1.636 . . . . 0.0 112.831 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -89.9 -37.15 14.61 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 -179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 47.7 t -55.56 -50.23 70.59 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.345 0.658 . . . . 0.0 110.992 172.188 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.2 pp -67.51 -34.1 76.42 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.465 -0.778 . . . . 0.0 112.962 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.0 -42.9 99.97 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.973 0.806 . . . . 0.0 111.697 -174.525 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 70.1 mtt-85 -70.03 -44.94 68.22 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.665 -0.647 . . . . 0.0 111.81 171.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.2 tt -50.08 -61.55 2.09 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.231 1.013 . . . . 0.0 111.533 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.97 -27.51 68.33 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.514 -1.366 . . . . 0.0 113.387 179.16 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.69 -43.5 68.9 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 124.127 0.892 . . . . 0.0 111.566 177.082 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -53.98 -52.39 60.87 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.641 0.776 . . . . 0.0 111.545 176.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.18 -42.71 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 O-C-N 121.371 -0.831 . . . . 0.0 111.922 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.41 ' HB2' ' CZ ' ' A' ' 129' ' ' ARG . . . -70.28 -31.03 68.21 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.029 -1.045 . . . . 0.0 113.596 -178.386 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.08 -63.97 0.95 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.417 0.687 . . . . 0.0 110.483 169.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -62.06 -50.44 71.96 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.19 2.196 . . . . 0.0 113.929 -171.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.441 HD12 ' HB1' ' A' ' 128' ' ' ALA . 2.6 mm? -78.59 164.47 24.64 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 122.276 1.036 . . . . 0.0 110.328 176.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -77.2 -94.13 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.183 0.993 . . . . 0.0 111.447 -169.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.519 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 37.6 tt0 -140.79 -58.68 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 124.646 1.178 . . . . 0.0 110.454 167.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.519 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.2 Cg_endo -66.88 -35.75 25.68 Favored 'Trans proline' 0 C--N 1.352 0.739 0 CA-C-N 122.036 1.763 . . . . 0.0 111.484 176.047 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.441 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -57.98 -32.01 67.46 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 120.98 -1.075 . . . . 0.0 112.779 173.132 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.41 ' CZ ' ' HB2' ' A' ' 121' ' ' ALA . 0.0 OUTLIER -64.14 -48.77 74.73 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.063 1.345 . . . . 0.0 109.903 173.499 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.19 -34.32 87.63 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 126.415 1.959 . . . . 0.0 114.49 176.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -74.98 -30.71 61.26 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.777 1.288 . . . . 0.0 110.475 173.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.86 58.42 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 122.909 0.484 . . . . 0.0 110.357 -176.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -66.51 -39.76 88.85 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 118.914 -0.565 . . . . 0.0 111.841 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.42 -54.54 44.3 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.37 0.986 . . . . 0.0 111.913 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 9.2 mp -64.45 -25.96 68.23 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.698 176.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 59.7 ttp -65.78 -53.02 45.96 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 120.056 1.298 . . . . 0.0 111.831 172.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -66.92 -43.15 84.03 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.122 0.874 . . . . 0.0 111.619 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -28.16 68.29 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.412 1.085 . . . . 0.0 112.846 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -68.0 -47.74 67.68 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.468 -1.395 . . . . 0.0 111.186 167.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 85.8 mt -62.27 -38.58 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.387 1.075 . . . . 0.0 112.561 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -52.98 -32.92 48.85 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.215 1.806 . . . . 0.0 113.09 173.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -112.85 2.69 16.02 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.405 1.482 . . . . 0.0 114.02 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -72.39 -19.16 61.65 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.932 1.693 . . . . 0.0 112.681 175.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -88.92 136.96 32.73 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.477 1.111 . . . . 0.0 110.109 174.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -77.51 42.76 0.37 Allowed 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 124.944 1.298 . . . . 0.0 113.687 177.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 48.0 mt . . . . . 0 CA--C 1.547 0.843 0 C-N-CA 131.18 3.792 . . . . 0.0 117.018 -178.747 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 50.6 m170 . . . . . 0 CA--C 1.553 1.058 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 41.8 tp -128.09 73.67 79.37 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 126.373 1.869 . . . . 0.0 110.435 179.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -63.72 140.3 73.58 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.087 1.858 . . . . 0.0 110.453 171.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 75.1 p -104.57 152.62 22.2 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.739 0.816 . . . . 0.0 112.765 -170.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.4 t -159.04 128.88 5.66 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 123.793 0.837 . . . . 0.0 110.693 176.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 41.2 p90 -163.51 154.66 16.58 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.642 1.577 . . . . 0.0 111.372 178.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.3 mtt85 -172.5 143.18 1.34 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 126.428 1.891 . . . . 0.0 109.771 172.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -169.99 51.34 0.2 Allowed Glycine 0 CA--C 1.529 0.965 0 CA-C-O 119.33 -0.706 . . . . 0.0 114.566 -175.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . 0.257 21.0 p 55.21 -3.67 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 128.34 2.656 . . . . 0.0 117.841 177.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 62.1 m -120.63 -167.25 1.44 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 128.019 2.528 . . . . 0.0 111.041 173.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.4 p -142.68 144.89 23.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.883 1.273 . . . . 0.0 111.786 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -84.6 91.09 7.81 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 123.049 1.404 . . . . 0.0 108.884 171.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -54.78 -157.14 0.01 OUTLIER Glycine 0 CA--C 1.549 2.171 0 N-CA-C 116.719 1.447 . . . . 0.0 116.719 169.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.8 t -129.89 116.48 18.72 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.534 1.534 . . . . 0.0 110.0 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -78.1 178.98 7.12 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 128.041 2.536 . . . . 0.0 113.157 -174.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 32.5 p -115.35 161.67 18.19 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.771 1.229 . . . . 0.0 113.921 176.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.1 t -135.7 133.42 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 126.174 1.79 . . . . 0.0 109.541 -171.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -88.98 178.25 6.45 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.722 1.209 . . . . 0.0 112.961 177.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.53 -1.64 0.16 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 127.928 2.491 . . . . 0.0 117.718 -167.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 31.0 t -152.56 35.94 0.51 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.398 1.479 . . . . 0.0 111.372 173.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 87.47 -123.15 6.48 Favored Glycine 0 CA--C 1.529 0.912 0 O-C-N 120.934 -1.104 . . . . 0.0 110.649 -167.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 59.39 175.92 0.08 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.951 0.9 . . . . 0.0 111.665 -163.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.9 132.48 52.8 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 117.788 -1.101 . . . . 0.0 108.901 165.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.3 mt -98.69 150.51 21.72 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.916 1.235 . . . . 0.0 112.316 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 24.5 mt -63.62 111.81 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 125.144 1.378 . . . . 0.0 110.628 -173.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -142.74 154.38 44.22 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.76 1.224 . . . . 0.0 112.291 -173.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -101.03 -10.54 20.43 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -164.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -64.69 -29.48 70.47 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.892 0.877 . . . . 0.0 111.66 168.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 64.5 mt -49.77 -40.38 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 125.778 1.631 . . . . 0.0 112.103 175.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.18 -53.19 58.84 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 121.417 -0.802 . . . . 0.0 110.978 173.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -61.45 -30.0 70.31 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.823 0.849 . . . . 0.0 111.997 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.88 -53.52 52.84 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.984 1.714 . . . . 0.0 111.746 173.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -60.94 -43.55 98.51 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.32 -0.848 . . . . 0.0 112.416 173.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.47 -40.65 87.64 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.179 1.354 . . . . 0.0 112.636 177.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.88 -20.78 66.61 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -112.39 -21.74 11.22 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.365 1.066 . . . . 0.0 113.656 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.12 -48.94 74.12 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 118.998 0.817 . . . . 0.0 110.079 169.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 11.3 m -68.73 -18.57 64.25 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.809 0.843 . . . . 0.0 113.137 179.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -81.86 -7.53 59.61 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -176.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 8.9 p -69.56 -40.82 80.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -169.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 53.82 -128.82 40.81 Favored Glycine 0 CA--C 1.538 1.509 0 O-C-N 121.602 -0.686 . . . . 0.0 112.75 -171.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -87.87 -12.23 45.46 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.748 1.219 . . . . 0.0 113.573 176.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -75.65 147.56 81.68 Favored Pre-proline 0 CA--C 1.546 0.789 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -164.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -63.97 139.01 65.5 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 122.351 2.034 . . . . 0.0 111.432 177.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 18.1 mt -52.09 -26.91 12.24 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 -173.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -46.24 -43.22 15.3 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.93 1.292 . . . . 0.0 113.477 176.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -80.69 -39.6 26.87 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 120.318 1.417 . . . . 0.0 113.329 -176.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 38.6 t -64.94 -44.12 90.48 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.546 -0.721 . . . . 0.0 110.941 176.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.1 pp -68.45 -29.27 67.88 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 118.127 -0.939 . . . . 0.0 112.576 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -62.21 -58.43 7.77 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.041 0.837 . . . . 0.0 110.809 174.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.4 mtt85 -59.97 -40.61 89.69 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.071 -1.018 . . . . 0.0 112.263 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 50.5 tp -62.12 -57.35 11.88 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.795 0.838 . . . . 0.0 112.496 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.6 ptm85 -60.91 -33.8 73.7 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.677 -0.639 . . . . 0.0 111.589 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.66 -44.02 87.58 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 124.198 0.936 . . . . 0.0 111.421 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.74 -42.7 81.42 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.477 0.711 . . . . 0.0 110.741 176.091 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 18.0 mt -61.09 -42.44 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.259 -0.901 . . . . 0.0 111.208 176.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.38 -22.2 61.91 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -84.64 -31.62 24.1 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 171.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -99.73 -34.77 10.04 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 115.324 1.601 . . . . 0.0 115.324 -173.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 60.2 mt -81.72 174.32 11.47 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.394 0.997 . . . . 0.0 111.611 167.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.34 -97.56 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.93 0.892 . . . . 0.0 111.525 -176.267 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.445 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 49.3 tt0 -145.43 -57.54 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.629 0 O-C-N 120.964 -1.085 . . . . 0.0 110.293 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.445 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.7 Cg_endo -69.76 -37.94 8.49 Favored 'Trans proline' 0 C--N 1.355 0.897 0 CA-C-N 121.581 1.6 . . . . 0.0 112.133 173.109 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.73 -39.85 68.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.699 1.2 . . . . 0.0 112.157 176.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -58.17 -46.81 85.09 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.128 1.371 . . . . 0.0 110.74 174.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -56.3 -34.37 62.97 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 125.363 1.459 . . . . 0.0 113.621 175.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -77.61 -30.6 52.46 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 118.622 1.211 . . . . 0.0 111.494 175.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.36 -45.4 60.03 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.541 -0.725 . . . . 0.0 111.291 -178.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.79 -34.11 75.0 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.611 -0.709 . . . . 0.0 112.371 173.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.87 -53.58 56.18 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 119.144 0.884 . . . . 0.0 111.614 173.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 72.6 mt -55.41 -37.16 67.26 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.05 0.54 . . . . 0.0 111.328 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -52.51 46.56 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.051 0.94 . . . . 0.0 111.933 177.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -64.68 -38.94 92.71 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.735 -1.228 . . . . 0.0 112.834 178.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.89 -43.76 98.19 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.837 1.255 . . . . 0.0 111.165 172.291 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -60.51 -39.87 89.32 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.533 -0.73 . . . . 0.0 111.566 172.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 59.7 mt -67.13 -35.21 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 119.934 1.243 . . . . 0.0 112.359 177.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -58.02 -49.78 75.68 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.492 0.717 . . . . 0.0 110.32 170.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -93.08 -0.53 57.05 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -173.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -65.35 -36.43 84.0 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.437 1.095 . . . . 0.0 112.646 -178.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 5.7 ptpp? -100.31 177.26 5.1 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.957 0.903 . . . . 0.0 110.902 169.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 57.64 33.17 22.91 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 6.2 mp . . . . . 0 CA--C 1.548 0.892 0 C-N-CA 127.002 2.121 . . . . 0.0 114.683 170.09 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 80.1 m80 . . . . . 0 CA--C 1.539 0.536 0 CA-C-O 120.914 0.388 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.7 mp -122.24 159.7 50.99 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 127.702 2.401 . . . . 0.0 109.049 174.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -73.97 60.75 4.63 Favored 'Trans proline' 0 CA--C 1.549 1.243 0 C-N-CA 124.574 3.516 . . . . 0.0 113.08 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 76.2 p -103.19 116.45 32.49 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.849 -1.157 . . . . 0.0 113.269 -169.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.0 p -92.54 -175.04 3.86 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.952 1.701 . . . . 0.0 111.461 161.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 46.3 49.07 13.15 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 126.521 1.929 . . . . 0.0 114.015 178.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.16 137.49 53.37 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 120.857 -1.152 . . . . 0.0 112.341 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -154.12 135.55 4.81 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 126.632 2.063 . . . . 0.0 108.151 168.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.9 t -132.48 12.53 4.52 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.041 0.936 . . . . 0.0 112.122 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -77.75 40.08 0.3 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 128.051 2.54 . . . . 0.0 112.797 -173.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.9 m -137.9 143.67 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.032 1.333 . . . . 0.0 111.582 -164.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -160.45 110.26 1.76 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.979 1.312 . . . . 0.0 108.862 176.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -77.37 129.34 9.54 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-O 118.967 -0.907 . . . . 0.0 111.022 166.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.7 t -102.32 46.88 0.91 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.475 1.91 . . . . 0.0 109.951 168.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -63.24 163.92 9.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.504 1.122 . . . . 0.0 111.689 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.6 p -112.35 149.64 32.18 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.368 1.067 . . . . 0.0 113.072 -173.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.1 t -122.5 129.87 74.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.988 1.715 . . . . 0.0 109.67 -173.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -80.74 179.81 7.62 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.997 1.719 . . . . 0.0 112.537 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.29 -3.41 0.62 Allowed 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 116.603 2.075 . . . . 0.0 116.603 -172.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.7 m -162.6 64.59 0.21 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.671 1.988 . . . . 0.0 109.864 168.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.72 -123.91 6.4 Favored Glycine 0 CA--C 1.53 1.022 0 O-C-N 121.478 -0.764 . . . . 0.0 111.601 -177.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.9 m120 57.25 179.42 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.848 1.259 . . . . 0.0 112.972 -171.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.79 118.6 36.59 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.242 -0.911 . . . . 0.0 109.376 169.465 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.8 mt -84.77 160.87 20.18 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 122.145 0.974 . . . . 0.0 111.611 171.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 15.9 mt -80.33 91.64 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 124.448 1.099 . . . . 0.0 110.4 -173.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 53.4 p -133.24 153.79 51.24 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.699 1.199 . . . . 0.0 110.708 164.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 8.9 tpp85 -70.49 -7.92 47.26 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -162.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -55.36 -44.93 76.45 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 127.108 2.163 . . . . 0.0 115.061 -167.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 39.5 pt -60.4 -28.47 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 123.826 0.851 . . . . 0.0 112.828 -173.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 62.5 ttt-85 -68.55 -35.89 78.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 122.672 0.389 . . . . 0.0 110.95 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -79.24 -34.24 42.88 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.283 0.633 . . . . 0.0 111.804 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.8 mp -56.96 -51.59 68.61 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.889 -0.577 . . . . 0.0 111.509 165.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -61.26 -42.96 99.53 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.956 0.798 . . . . 0.0 111.697 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.02 -41.88 97.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.33 0.968 . . . . 0.0 112.668 -179.271 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.92 -44.9 96.56 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.276 -0.89 . . . . 0.0 111.824 178.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -83.68 -8.96 59.17 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.2 mt -78.91 -33.19 45.76 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.812 1.187 . . . . 0.0 112.473 169.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 12.5 t -77.07 -38.07 53.26 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.259 0.936 . . . . 0.0 112.274 171.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -89.35 24.13 2.31 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.593 1.157 . . . . 0.0 113.882 171.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 8.4 p -61.67 -25.1 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 O-C-N 121.034 -1.041 . . . . 0.0 113.632 -171.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 110.48 153.34 13.59 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 125.064 1.316 . . . . 0.0 112.341 -176.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -109.5 -12.71 14.67 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.428 1.091 . . . . 0.0 111.28 174.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.492 ' H ' ' HD2' ' A' ' 108' ' ' PRO . 23.8 mm-40 -150.9 -55.52 0.02 OUTLIER Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 128.509 2.724 . . . . 0.0 112.713 173.208 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.492 ' HD2' ' H ' ' A' ' 107' ' ' GLU . 92.9 Cg_endo -75.14 52.05 3.0 Favored 'Trans proline' 0 CA--C 1.55 1.302 0 C-N-CA 124.542 3.495 . . . . 0.0 115.139 -173.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.65 -40.75 69.31 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.467 1.907 . . . . 0.0 112.187 -178.541 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -63.15 -22.94 67.2 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -93.76 -37.1 11.96 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.004 0.82 . . . . 0.0 113.094 -176.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 75.9 p -63.38 -42.39 98.84 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 122.937 0.495 . . . . 0.0 110.482 173.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.35 -35.81 81.31 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 118.321 -0.847 . . . . 0.0 112.416 177.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -66.52 -41.26 89.05 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 119.47 1.032 . . . . 0.0 112.108 -174.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -69.3 -41.8 76.27 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 120.924 -1.11 . . . . 0.0 112.466 170.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 46.2 tp -51.47 -63.38 1.15 Allowed 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.044 0.537 . . . . 0.0 111.701 175.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -30.66 68.1 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.273 1.029 . . . . 0.0 112.75 177.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.54 -39.9 94.62 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 174.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -62.65 -51.38 67.5 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.062 0.846 . . . . 0.0 111.9 174.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.415 HD12 ' H ' ' A' ' 120' ' ' ILE . 4.4 mp -58.75 -41.53 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.319 0.963 . . . . 0.0 111.118 177.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.1 -18.13 63.94 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -101.32 -33.2 10.13 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -78.52 -45.46 21.87 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.382 1.073 . . . . 0.0 112.45 177.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.431 HD12 ' HB1' ' A' ' 128' ' ' ALA . 2.6 mm? -84.89 174.88 9.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.12 0.968 . . . . 0.0 111.574 176.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -89.85 -99.99 0.1 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.282 0.633 . . . . 0.0 112.288 -177.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.438 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 17.6 tt0 -135.22 -63.9 0.02 OUTLIER Pre-proline 0 N--CA 1.472 0.657 0 O-C-N 120.807 -1.183 . . . . 0.0 109.138 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.438 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 87.5 Cg_endo -68.58 -34.03 20.66 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 CA-C-N 121.127 1.438 . . . . 0.0 111.702 173.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.431 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -60.75 -36.39 78.8 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 120.77 -1.206 . . . . 0.0 112.078 174.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -63.91 -49.51 72.37 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.509 1.124 . . . . 0.0 110.413 172.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.32 -34.13 73.29 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.871 1.224 . . . . 0.0 113.879 178.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -75.08 -33.67 61.69 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.466 1.133 . . . . 0.0 110.682 175.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.47 -46.13 64.36 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.698 -0.626 . . . . 0.0 110.926 -176.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.29 -36.63 79.65 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 118.804 -0.617 . . . . 0.0 112.176 174.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.7 -54.08 49.63 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.301 0.955 . . . . 0.0 111.976 175.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 97.0 mt -58.7 -34.73 71.64 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.395 176.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 49.5 ttp -65.38 -52.02 56.45 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.4 0.68 . . . . 0.0 112.26 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -64.33 -42.9 96.06 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.768 -0.582 . . . . 0.0 111.604 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -61.75 -44.9 95.99 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.604 1.162 . . . . 0.0 111.715 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -59.9 -44.48 94.22 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.155 0.434 . . . . 0.0 111.467 174.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 74.6 mt -62.24 -35.32 68.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 118.686 0.675 . . . . 0.0 111.414 176.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -63.02 -32.19 73.5 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.029 0.932 . . . . 0.0 113.111 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 3.5 p90 -108.81 -0.14 20.05 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 116.242 1.941 . . . . 0.0 116.242 174.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -55.47 -43.81 75.86 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.752 1.621 . . . . 0.0 112.634 178.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 42.7 mtpt -111.51 142.13 44.18 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.443 1.497 . . . . 0.0 110.759 -176.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -76.83 56.46 1.18 Allowed 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.048 1.339 . . . . 0.0 112.787 -177.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 83.9 mt . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 129.669 3.188 . . . . 0.0 118.087 176.096 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 48.6 m170 . . . . . 0 CA--C 1.54 0.572 0 CA-C-O 120.544 0.212 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.8 mp -128.39 151.5 76.66 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 125.269 1.428 . . . . 0.0 110.926 -177.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -67.32 170.29 13.71 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.211 3.274 . . . . 0.0 113.58 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.9 t -58.81 131.2 50.25 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 122.608 1.194 . . . . 0.0 112.306 -174.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.2 p -178.06 167.23 2.02 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 128.304 2.642 . . . . 0.0 107.274 -167.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -46.99 106.02 0.08 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.978 0.911 . . . . 0.0 112.922 -174.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.59 123.79 33.42 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.621 1.168 . . . . 0.0 111.88 -173.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -177.87 141.98 5.41 Favored Glycine 0 CA--C 1.526 0.77 0 C-N-CA 125.678 1.609 . . . . 0.0 110.34 168.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.44 44.68 1.97 Allowed 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 122.871 1.32 . . . . 0.0 110.282 -174.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.5 t -138.92 148.86 44.14 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 127.667 2.387 . . . . 0.0 109.263 173.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 13.3 p -57.92 169.01 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.07 0 C-N-CA 127.132 2.173 . . . . 0.0 112.568 172.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -131.8 -18.65 2.7 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.591 1.556 . . . . 0.0 115.141 -179.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -140.41 144.31 14.69 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.552 1.072 . . . . 0.0 111.623 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.8 t -78.33 74.03 4.87 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.636 1.174 . . . . 0.0 111.397 -179.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -65.78 152.79 43.54 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.801 0.81 . . . . 0.0 111.602 177.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 98.5 p -133.56 157.8 44.77 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.867 0.841 . . . . 0.0 113.002 -173.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.6 t -127.71 130.93 70.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.338 1.455 . . . . 0.0 110.088 -166.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -79.12 173.32 12.7 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.346 1.858 . . . . 0.0 113.632 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.54 -10.12 2.03 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 -177.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 19.8 m -138.29 29.88 2.44 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.793 1.637 . . . . 0.0 111.848 175.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 93.13 -109.08 3.74 Favored Glycine 0 C--N 1.339 0.746 0 O-C-N 120.445 -1.409 . . . . 0.0 110.766 -173.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 128' ' ' ALA . 71.4 m-20 52.05 -172.16 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.679 1.191 . . . . 0.0 113.758 -174.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -113.48 126.03 54.87 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 164.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.5 mt -91.61 140.96 29.23 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.338 0.972 . . . . 0.0 110.27 170.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 31.6 mm -80.68 105.46 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.917 0.865 . . . . 0.0 110.851 -178.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.1 p -132.56 22.63 4.33 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 125.255 1.422 . . . . 0.0 113.247 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 64.24 -4.39 0.41 Allowed 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 126.811 2.045 . . . . 0.0 115.88 177.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -54.78 -53.83 50.08 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 129.23 3.012 . . . . 0.0 114.834 178.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 30.2 pt -54.77 -33.3 27.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.928 0.891 . . . . 0.0 113.177 -177.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -65.01 -38.58 91.41 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.984 1.265 . . . . 0.0 112.217 177.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -67.97 -35.11 77.81 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.238 0.615 . . . . 0.0 111.553 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.18 -44.02 80.72 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.807 0.843 . . . . 0.0 111.35 174.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -63.6 -43.6 96.44 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.099 0.863 . . . . 0.0 112.693 171.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -58.09 -46.43 85.51 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.599 1.09 . . . . 0.0 112.75 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.62 -30.97 67.66 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -102.19 -12.17 18.23 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 24.7 mt -74.86 -41.1 60.46 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.617 1.098 . . . . 0.0 111.376 167.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 5.7 t -67.05 -47.37 71.54 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.322 0.51 . . . . 0.0 110.852 175.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -87.61 23.55 1.92 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.76 1.624 . . . . 0.0 114.996 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 7.2 p -61.33 -25.57 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 N-CA-C 114.22 1.192 . . . . 0.0 114.22 -171.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.06 178.65 49.92 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.549 1.071 . . . . 0.0 113.699 -177.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -134.78 -61.44 0.76 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.373 1.069 . . . . 0.0 109.727 -175.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -77.79 -54.16 1.39 Allowed Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 124.572 1.149 . . . . 0.0 113.771 168.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -77.89 33.34 0.45 Allowed 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 124.292 3.328 . . . . 0.0 114.267 -175.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.28 -35.89 63.05 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.503 1.921 . . . . 0.0 113.126 -171.021 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.83 -40.76 92.07 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.364 -0.835 . . . . 0.0 112.698 177.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -83.77 -28.56 28.08 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 121.013 -1.054 . . . . 0.0 112.971 -172.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 68.6 p -65.13 -44.92 87.11 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 118.56 0.618 . . . . 0.0 111.181 175.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.8 -27.89 66.28 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 122.555 0.342 . . . . 0.0 111.617 175.484 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -72.22 -46.75 54.79 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 111.417 0.154 . . . . 0.0 111.417 -174.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -66.23 -35.47 80.51 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 118.451 -0.785 . . . . 0.0 111.821 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.466 ' O ' HD12 ' A' ' 120' ' ' ILE . 55.3 tp -57.94 -61.81 2.27 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.623 0.769 . . . . 0.0 111.025 176.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -60.58 -27.79 67.97 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.278 -0.889 . . . . 0.0 112.726 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.07 -37.53 66.76 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.86 0.864 . . . . 0.0 113.044 173.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -63.68 -53.38 52.22 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.096 -0.954 . . . . 0.0 111.499 174.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.466 HD12 ' O ' ' A' ' 116' ' ' LEU . 3.7 mp -55.79 -36.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 120.633 1.56 . . . . 0.0 111.537 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.451 ' HA ' ' HD2' ' A' ' 129' ' ' ARG . . . -70.68 -24.78 62.74 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.537 1.68 . . . . 0.0 115.537 178.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -99.22 -29.31 12.9 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.997 1.319 . . . . 0.0 113.785 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -82.26 -46.14 14.08 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.484 1.514 . . . . 0.0 113.694 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 7.5 mp -89.21 176.3 7.01 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.02 0.928 . . . . 0.0 110.495 171.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -77.38 -96.94 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.941 0.896 . . . . 0.0 111.767 -175.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.47 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 34.7 tt0 -155.03 -52.65 0.02 OUTLIER Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 124.96 1.304 . . . . 0.0 110.909 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.47 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 56.7 Cg_endo -64.78 -43.9 11.59 Favored 'Trans proline' 0 C--N 1.353 0.804 0 CA-C-N 121.673 1.633 . . . . 0.0 109.948 167.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 86' ' ' ASN . . . -49.97 -38.83 38.68 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.851 1.261 . . . . 0.0 113.007 172.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.463 HH11 ' HD3' ' A' ' 129' ' ' ARG . 26.5 ttt180 -72.19 -42.53 65.73 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 121.602 -0.686 . . . . 0.0 110.869 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.8 -32.62 75.08 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-O 119.524 -0.598 . . . . 0.0 113.976 175.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -79.28 -30.35 42.93 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.34 1.07 . . . . 0.0 111.29 175.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.36 -46.91 63.16 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.646 -0.659 . . . . 0.0 111.109 -178.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.7 pp -66.79 -36.63 82.85 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.308 0.643 . . . . 0.0 112.393 175.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.99 -52.0 64.67 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.659 -0.65 . . . . 0.0 112.426 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.86 -28.82 69.76 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.489 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 9.4 tmm? -67.36 -53.47 29.19 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.044 0.838 . . . . 0.0 112.105 175.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.59 -42.32 98.69 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.07 -1.019 . . . . 0.0 113.363 172.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.37 -42.29 96.25 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.167 0.987 . . . . 0.0 111.959 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 32.7 t80 -59.56 -43.83 93.46 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.751 -0.593 . . . . 0.0 111.242 171.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.11 -41.74 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-O 118.667 -0.683 . . . . 0.0 112.132 -178.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -61.16 -49.91 75.31 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.091 0.956 . . . . 0.0 111.523 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.9 m-30 -89.01 6.62 38.84 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -175.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -64.8 -32.74 74.58 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.194 1.397 . . . . 0.0 112.188 174.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -85.47 134.38 34.06 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.4 1.88 . . . . 0.0 110.683 176.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -89.53 43.36 1.14 Allowed 'General case' 0 N--CA 1.479 0.991 0 O-C-N 121.1 -1.0 . . . . 0.0 113.056 170.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 7.1 mp . . . . . 0 CA--C 1.556 1.179 0 N-CA-C 116.714 2.116 . . . . 0.0 116.714 173.508 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 12.5 t-160 . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 70.2 mt 49.71 70.9 1.77 Allowed Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 125.196 1.398 . . . . 0.0 113.624 -178.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -59.5 131.04 38.31 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 122.013 1.808 . . . . 0.0 110.556 170.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.8 t -147.39 -12.75 0.4 Allowed 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -167.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.5 t -79.21 129.68 34.71 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.316 0.962 . . . . 0.0 111.877 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -80.21 144.07 33.24 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.209 1.004 . . . . 0.0 112.788 -178.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.22 -26.85 68.02 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -176.554 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -116.6 -167.27 14.62 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.383 1.468 . . . . 0.0 112.405 176.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.3 p -92.94 92.17 7.74 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.273 -1.134 . . . . 0.0 111.943 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.2 t -159.36 143.95 15.37 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.349 1.06 . . . . 0.0 111.663 168.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 15.7 m -157.22 165.77 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 127.504 2.322 . . . . 0.0 110.679 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.86 -38.0 77.77 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.997 2.119 . . . . 0.0 115.912 -174.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.63 -141.08 25.12 Favored Glycine 0 CA--C 1.547 2.062 0 C-N-CA 125.503 1.525 . . . . 0.0 114.834 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.4 t -148.7 155.3 40.83 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.868 2.067 . . . . 0.0 109.886 -175.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.803 ' HA ' ' OD1' ' A' ' 92' ' ' ASP . 6.6 p90 -147.54 172.96 13.17 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -164.084 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 94.0 p -88.29 168.03 13.05 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.821 2.049 . . . . 0.0 114.883 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 p -154.22 136.89 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 125.541 1.537 . . . . 0.0 111.484 -177.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -84.35 170.95 13.1 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.632 1.173 . . . . 0.0 111.579 173.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.96 3.76 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 117.688 2.477 . . . . 0.0 117.688 -170.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 39.5 m -159.22 52.09 0.38 Allowed 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.008 1.723 . . . . 0.0 110.109 168.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.89 -124.35 6.43 Favored Glycine 0 CA--C 1.528 0.899 0 O-C-N 120.2 -1.562 . . . . 0.0 111.228 -174.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 m120 59.79 177.8 0.09 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.333 1.053 . . . . 0.0 111.615 -169.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.1 mt -112.14 128.23 56.16 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.824 -1.172 . . . . 0.0 109.536 170.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mt -95.52 161.83 13.9 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.992 0.901 . . . . 0.0 111.807 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.4 mm -83.87 89.64 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 124.599 1.16 . . . . 0.0 111.494 -173.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 69.3 p -141.62 166.43 24.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.709 175.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.418 ' CG ' ' HD3' ' A' ' 94' ' ' ARG . 43.7 ttm-85 -93.02 45.41 1.18 Allowed 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 115.005 -0.998 . . . . 0.0 113.398 -164.384 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.803 ' OD1' ' HA ' ' A' ' 79' ' ' PHE . 0.2 OUTLIER -102.71 -60.16 1.59 Allowed 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.614 -0.679 . . . . 0.0 112.691 -178.358 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 20.8 pt -47.41 -24.04 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -176.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.418 ' HD3' ' CG ' ' A' ' 91' ' ' ARG . 9.5 ptm85 -74.06 -31.03 62.69 Favored 'General case' 0 N--CA 1.456 -0.127 0 O-C-N 120.896 -1.127 . . . . 0.0 111.249 -177.312 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -74.4 -32.03 62.55 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.317 1.047 . . . . 0.0 111.032 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.3 tt -63.44 -52.75 60.14 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.577 1.551 . . . . 0.0 110.661 176.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -56.58 -46.01 81.02 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.295 -0.878 . . . . 0.0 112.731 169.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.57 -38.87 85.98 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 119.661 1.119 . . . . 0.0 112.55 -179.163 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.82 -37.17 83.45 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.189 0.996 . . . . 0.0 112.982 178.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -99.85 -3.66 32.07 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 34.7 mt -82.85 -24.06 33.42 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.194 -0.942 . . . . 0.0 112.892 166.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 70.2 m -85.09 138.76 32.21 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 170.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 59.23 18.21 6.38 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 116.307 1.965 . . . . 0.0 116.307 166.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 11.7 p -53.44 -28.45 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 -167.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 170.75 151.11 7.35 Favored Glycine 0 CA--C 1.526 0.758 0 C-N-CA 125.327 1.442 . . . . 0.0 110.357 175.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -82.88 -39.22 21.85 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 117.273 0.536 . . . . 0.0 112.131 -179.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -156.19 -56.06 0.02 OUTLIER Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 125.994 1.718 . . . . 0.0 113.272 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -71.34 69.43 2.58 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 124.589 3.526 . . . . 0.0 113.293 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.21 75.81 1.3 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.019 1.327 . . . . 0.0 111.485 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -128.74 -76.11 0.56 Allowed 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.888 1.275 . . . . 0.0 110.868 169.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.72 -29.98 70.46 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -167.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.1 m -57.85 -46.03 85.38 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.234 0.924 . . . . 0.0 112.154 174.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.73 -36.75 76.14 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 122.396 0.278 . . . . 0.0 110.438 178.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -65.33 -37.12 86.13 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 122.698 0.399 . . . . 0.0 111.48 -176.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -72.14 -45.01 62.23 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 117.568 -1.206 . . . . 0.0 111.767 172.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 42.6 tp -49.47 -63.36 1.13 Allowed 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 118.995 0.816 . . . . 0.0 111.791 176.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -60.8 -30.91 70.34 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.911 -1.118 . . . . 0.0 112.709 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.38 -38.03 84.1 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 175.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -60.33 -51.2 70.51 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 119.15 0.886 . . . . 0.0 111.131 173.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.5 mp -58.59 -42.26 84.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-N 119.107 0.867 . . . . 0.0 111.318 175.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.02 -20.97 63.24 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 115.344 1.609 . . . . 0.0 115.344 -178.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -98.05 -37.39 9.77 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.881 1.272 . . . . 0.0 113.218 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -73.12 -52.43 14.26 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.724 0.81 . . . . 0.0 112.979 173.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -83.83 159.18 21.44 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 122.4 1.095 . . . . 0.0 109.983 175.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -77.67 -84.41 0.07 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.423 -169.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -153.72 -61.6 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 117.961 -1.018 . . . . 0.0 110.405 -178.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -66.65 -38.33 18.83 Favored 'Trans proline' 0 C--N 1.352 0.761 0 CA-C-N 121.437 1.549 . . . . 0.0 110.731 170.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.14 -35.11 71.03 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 121.024 -1.047 . . . . 0.0 112.743 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 35.3 ttt180 -63.4 -47.62 81.23 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.879 1.272 . . . . 0.0 110.379 172.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.06 -34.72 73.77 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.258 1.408 . . . . 0.0 114.148 177.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -75.64 -32.8 60.37 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.356 1.078 . . . . 0.0 110.725 175.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.96 -46.69 64.73 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.734 -0.604 . . . . 0.0 110.968 -177.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.53 -35.35 77.34 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.37 -53.45 56.45 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.488 0.586 . . . . 0.0 112.064 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 88.4 mt -58.47 -34.1 70.5 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.246 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 44.1 ttp -65.53 -50.5 64.99 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.294 0.638 . . . . 0.0 112.469 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -64.65 -44.35 90.72 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.145 0.884 . . . . 0.0 112.172 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -62.2 -38.79 90.47 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.145 0.978 . . . . 0.0 111.426 178.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -62.92 -45.99 89.88 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.152 -0.968 . . . . 0.0 111.777 171.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 70.3 mt -64.96 -34.84 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 121.277 -0.89 . . . . 0.0 112.561 -177.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -61.51 -65.14 0.74 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.715 1.206 . . . . 0.0 110.356 169.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 12.4 m-30 -76.26 -2.94 33.87 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.893 1.277 . . . . 0.0 114.234 -171.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -55.73 -31.72 62.75 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.636 1.575 . . . . 0.0 112.035 170.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -89.22 126.21 35.4 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.443 1.097 . . . . 0.0 110.152 171.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -77.44 68.81 3.61 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.93 -0.481 . . . . 0.0 110.917 169.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 33.1 mt . . . . . 0 CA--C 1.547 0.855 0 C-N-CA 128.805 2.842 . . . . 0.0 118.183 175.309 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 24.0 m80 . . . . . 0 N--CA 1.469 0.5 0 CA-C-O 120.686 0.279 . . . . 0.0 111.393 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.6 tp -134.68 87.1 32.09 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 124.65 1.18 . . . . 0.0 110.94 177.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -64.95 145.72 86.18 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 121.865 1.71 . . . . 0.0 109.868 165.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 t -152.73 131.4 12.32 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 121.242 -0.911 . . . . 0.0 112.832 -167.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 55.9 p -87.7 51.45 2.22 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.94 1.696 . . . . 0.0 113.337 -176.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -80.42 160.7 25.25 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.257 -0.902 . . . . 0.0 112.395 172.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.82 128.03 32.94 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 167.032 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -69.81 93.39 0.39 Allowed Glycine 0 CA--C 1.535 1.326 0 C-N-CA 123.823 0.725 . . . . 0.0 113.745 -173.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.9 t -151.61 161.98 41.76 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.111 1.364 . . . . 0.0 111.93 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 53.9 m -78.05 161.35 27.51 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.389 1.076 . . . . 0.0 112.937 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.0 m -122.67 140.94 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 125.157 1.383 . . . . 0.0 111.987 -178.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -80.27 30.49 0.28 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.68 1.192 . . . . 0.0 113.213 173.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -73.11 31.24 0.78 Allowed Glycine 0 CA--C 1.538 1.519 0 O-C-N 120.105 -1.622 . . . . 0.0 116.564 -167.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.0 t -82.96 56.71 3.56 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 119.294 1.547 . . . . 0.0 113.662 -170.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -66.31 170.28 6.15 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.161 -0.962 . . . . 0.0 112.573 173.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.1 p -110.38 161.1 15.98 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.959 1.304 . . . . 0.0 113.418 176.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.9 t -123.27 135.56 62.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 125.701 1.6 . . . . 0.0 109.748 -175.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -80.42 173.66 12.38 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.571 1.549 . . . . 0.0 112.767 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.5 -28.73 32.61 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -170.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.8 m -128.88 43.42 3.15 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.588 1.955 . . . . 0.0 111.029 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.25 -122.12 5.84 Favored Glycine 0 CA--C 1.528 0.9 0 O-C-N 120.938 -1.101 . . . . 0.0 111.288 -174.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 56.12 -176.58 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.319 1.048 . . . . 0.0 113.562 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mt -110.1 133.63 53.01 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.214 -0.928 . . . . 0.0 109.575 173.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 12.8 mt -106.31 144.36 33.12 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 122.005 0.907 . . . . 0.0 110.693 169.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 23.4 mt -64.95 113.63 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 124.151 0.98 . . . . 0.0 110.238 -173.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -143.19 142.09 31.33 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.205 1.402 . . . . 0.0 111.344 -175.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 27.0 ttm180 -65.88 -25.49 67.2 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.507 1.123 . . . . 0.0 112.972 -173.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.43 -29.89 68.08 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 128.649 2.78 . . . . 0.0 112.334 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 82.1 mt -56.27 -39.06 57.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.336 1.054 . . . . 0.0 111.647 173.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -68.22 -35.88 78.66 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 121.006 -1.059 . . . . 0.0 112.362 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -66.23 -31.31 72.05 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.058 0.543 . . . . 0.0 111.251 173.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.36 -44.63 78.53 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.944 0.897 . . . . 0.0 111.457 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -63.87 -44.96 91.5 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 118.285 -0.864 . . . . 0.0 113.176 167.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -39.79 94.48 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 120.624 1.556 . . . . 0.0 112.453 -177.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.94 -13.05 42.8 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -113.95 -12.17 12.68 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.546 1.138 . . . . 0.0 113.241 172.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 34.0 mt -78.9 -39.53 34.72 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.385 0.993 . . . . 0.0 111.484 172.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.1 p -66.86 -41.09 87.91 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.986 0.812 . . . . 0.0 110.95 171.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -83.58 21.38 1.23 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.022 1.729 . . . . 0.0 114.603 176.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 12.0 p -55.07 -33.39 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 C-N-CA 124.763 1.225 . . . . 0.0 113.683 -173.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 123.33 115.93 2.25 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.708 1.146 . . . . 0.0 113.298 170.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -73.3 -18.73 61.17 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.138 0.975 . . . . 0.0 112.951 175.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.445 ' H ' ' HD2' ' A' ' 108' ' ' PRO . 15.8 mt-10 -145.99 -59.85 0.02 OUTLIER Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 127.848 2.459 . . . . 0.0 112.279 175.382 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.445 ' HD2' ' H ' ' A' ' 107' ' ' GLU . 68.7 Cg_endo -78.43 53.32 4.5 Favored 'Trans proline' 0 CA--C 1.548 1.182 0 C-N-CA 123.946 3.098 . . . . 0.0 114.489 -170.335 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 40.2 tp -51.88 -47.64 64.42 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.913 1.685 . . . . 0.0 113.23 -177.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -58.86 -35.24 72.63 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.291 1.036 . . . . 0.0 112.621 177.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -79.87 -31.93 40.41 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.231 -0.918 . . . . 0.0 112.169 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.4 t -65.48 -43.52 90.0 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 122.762 0.425 . . . . 0.0 111.877 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.17 -35.53 81.1 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 121.921 -0.487 . . . . 0.0 111.514 173.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -65.87 -46.06 79.84 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.957 0.503 . . . . 0.0 110.519 -176.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 19.5 ptt-85 -64.74 -31.08 72.15 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 117.846 -1.073 . . . . 0.0 113.356 171.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.21 -61.27 2.48 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.563 1.074 . . . . 0.0 109.995 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -59.35 -29.69 67.85 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.508 1.123 . . . . 0.0 113.189 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.03 -45.21 71.03 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.602 0.761 . . . . 0.0 112.183 173.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -53.42 -48.97 68.26 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.066 0.946 . . . . 0.0 112.597 176.013 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.438 HG22 ' HG3' ' A' ' 129' ' ' ARG . 3.9 mp -62.12 -38.62 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 O-C-N 121.372 -0.83 . . . . 0.0 111.864 175.617 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.66 -24.63 61.06 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -83.64 -42.37 16.76 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.684 1.194 . . . . 0.0 112.486 173.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -79.12 -46.94 17.01 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.702 1.201 . . . . 0.0 113.04 -178.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.484 HD12 ' HB1' ' A' ' 128' ' ' ALA . 2.2 mm? -88.27 171.77 9.93 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 122.654 1.216 . . . . 0.0 110.935 177.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.92 -108.16 0.09 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.736 1.215 . . . . 0.0 111.749 -176.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.445 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 47.7 tt0 -126.68 -63.9 0.02 OUTLIER Pre-proline 0 N--CA 1.47 0.552 0 O-C-N 120.337 -1.477 . . . . 0.0 108.975 -175.095 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.445 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 72.5 Cg_endo -68.78 -38.37 10.35 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 120.764 1.309 . . . . 0.0 111.568 173.001 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.484 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -59.9 -29.65 68.49 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.028 -1.045 . . . . 0.0 111.957 177.051 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.438 ' HG3' HG22 ' A' ' 120' ' ' ILE . 51.6 ttt180 -72.73 -45.45 58.63 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.942 0.401 . . . . 0.0 110.183 177.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.57 -35.49 80.73 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 115.459 -0.792 . . . . 0.0 113.762 176.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -72.65 -34.59 67.38 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.467 1.134 . . . . 0.0 110.747 175.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.03 -44.02 61.31 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.167 0.587 . . . . 0.0 111.285 -174.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -69.6 -36.18 75.98 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 119.032 -0.508 . . . . 0.0 112.074 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.66 -53.56 54.55 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.067 0.849 . . . . 0.0 111.782 174.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.4 mt -56.29 -35.29 67.34 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.679 0.792 . . . . 0.0 111.501 175.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 53.4 ttp -66.86 -51.3 57.12 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.434 0.693 . . . . 0.0 112.561 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -64.44 -40.8 96.44 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.436 -0.79 . . . . 0.0 111.66 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -62.06 -43.68 98.3 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.84 1.256 . . . . 0.0 111.377 176.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -60.35 -45.21 94.28 Favored 'General case' 0 C--O 1.221 -0.426 0 O-C-N 121.636 -0.665 . . . . 0.0 111.241 173.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 85.5 mt -67.94 -34.34 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.743 0.817 . . . . 0.0 112.861 -178.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -69.58 -49.69 51.75 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.617 0.767 . . . . 0.0 111.406 172.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 14.0 m-30 -79.93 -0.42 34.96 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.125 -0.984 . . . . 0.0 113.49 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -56.84 -26.21 57.84 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 126.441 1.896 . . . . 0.0 113.316 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -159.07 139.67 12.47 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.715 1.606 . . . . 0.0 112.418 167.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -86.0 18.71 2.89 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 125.162 1.385 . . . . 0.0 112.479 165.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 47.8 mt . . . . . 0 N--CA 1.479 1.011 0 C-N-CA 128.023 2.529 . . . . 0.0 116.719 178.425 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 . . . . . 0 CA--C 1.545 0.781 0 CA-C-O 119.317 -0.373 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 27.6 tp -124.62 68.53 52.35 Favored Pre-proline 0 CA--C 1.557 1.237 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -167.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -62.91 125.08 15.18 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.974 2.449 . . . . 0.0 111.396 177.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 8.9 p -158.32 161.29 37.63 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 126.545 1.938 . . . . 0.0 110.79 -169.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 79.5 p -69.68 145.2 52.55 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.091 0.86 . . . . 0.0 113.098 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.3 p90 -163.02 171.66 16.16 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.507 1.523 . . . . 0.0 111.977 173.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 17.6 mtt180 -88.86 -57.77 2.79 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 125.152 1.381 . . . . 0.0 112.741 167.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -163.19 21.99 0.17 Allowed Glycine 0 CA--C 1.534 1.239 0 N-CA-C 116.377 1.311 . . . . 0.0 116.377 -175.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.2 p 48.41 37.58 9.07 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 115.429 1.64 . . . . 0.0 115.429 173.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 44.7 t -109.45 141.72 41.47 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.087 1.355 . . . . 0.0 111.444 176.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 16.4 m -149.24 142.35 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 126.728 2.011 . . . . 0.0 110.183 177.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -94.51 24.79 4.31 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.023 1.329 . . . . 0.0 113.304 176.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.18 118.38 14.07 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.434 1.016 . . . . 0.0 112.776 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.4 t -150.63 21.83 0.81 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.072 1.749 . . . . 0.0 113.405 -165.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -50.08 156.66 0.75 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 128.509 2.724 . . . . 0.0 114.432 175.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.7 p -106.27 157.81 17.32 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.547 1.139 . . . . 0.0 112.995 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.5 t -124.45 129.92 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.374 1.47 . . . . 0.0 110.0 -171.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -77.32 171.01 15.53 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.985 2.114 . . . . 0.0 113.138 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.14 2.71 0.08 Allowed 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 127.72 2.408 . . . . 0.0 116.373 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 42.7 m -154.05 37.26 0.44 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.529 1.931 . . . . 0.0 111.31 169.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.84 -103.84 3.1 Favored Glycine 0 CA--C 1.527 0.789 0 O-C-N 120.872 -1.143 . . . . 0.0 111.854 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 49.89 -166.89 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.304 1.442 . . . . 0.0 112.88 -172.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mt -122.56 129.99 52.53 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 120.598 -1.314 . . . . 0.0 108.214 162.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.8 mt -99.66 143.3 30.05 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.996 0.903 . . . . 0.0 111.388 174.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 48.3 mm -61.31 125.04 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 123.901 0.88 . . . . 0.0 110.91 -174.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.5 p -155.39 150.6 26.9 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.487 1.915 . . . . 0.0 110.335 -168.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 30.3 ttm180 -88.45 -12.16 43.91 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 -168.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -67.87 -29.38 68.48 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 117.613 -1.184 . . . . 0.0 111.803 169.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 45.4 mm -51.62 -36.56 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 119.972 1.26 . . . . 0.0 112.064 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.4 ttt85 -74.58 -41.16 60.99 Favored 'General case' 0 CA--C 1.521 -0.15 0 O-C-N 121.007 -1.058 . . . . 0.0 110.775 178.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -64.78 -28.28 69.47 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.437 176.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 tt -64.77 -47.75 77.01 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.478 1.511 . . . . 0.0 110.866 174.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -66.68 -42.3 86.75 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.61 -0.682 . . . . 0.0 112.451 171.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -58.12 -43.91 87.44 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.574 1.079 . . . . 0.0 112.842 177.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.69 -34.33 75.57 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -175.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -88.04 -32.19 18.91 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.525 1.13 . . . . 0.0 113.001 178.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.8 mt -57.21 -51.06 70.87 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.824 1.193 . . . . 0.0 110.696 170.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 62.6 m -68.69 -6.28 25.26 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.75 -2.89 24.28 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.795 1.406 . . . . 0.0 114.795 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 4.4 p -91.08 -47.41 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 119.88 1.218 . . . . 0.0 112.948 176.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 59.81 -111.39 3.48 Favored Glycine 0 CA--C 1.536 1.372 0 CA-C-N 119.031 0.832 . . . . 0.0 111.77 -173.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -106.73 7.79 30.61 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.011 1.324 . . . . 0.0 113.475 174.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -70.2 160.45 80.76 Favored Pre-proline 0 N--CA 1.464 0.267 0 O-C-N 120.054 -1.653 . . . . 0.0 111.331 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -69.83 131.3 20.86 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 122.324 2.016 . . . . 0.0 111.886 174.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.12 -26.77 66.51 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.377 1.071 . . . . 0.0 112.335 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 25.9 mm100 -50.85 -54.08 26.86 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.225 1.41 . . . . 0.0 114.219 -174.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.57 -33.1 58.5 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.022 -1.049 . . . . 0.0 113.499 176.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 50.4 m -60.61 -38.88 86.16 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.547 0.739 . . . . 0.0 111.575 178.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.29 -32.85 59.01 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 118.507 -0.758 . . . . 0.0 111.528 173.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.58 -47.07 83.02 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.569 0.622 . . . . 0.0 110.508 -175.56 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.71 -39.34 84.37 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.42 -0.8 . . . . 0.0 112.94 172.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 35.2 tp -59.65 -57.71 11.77 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.542 1.065 . . . . 0.0 111.917 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -23.24 66.76 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.61 -31.14 32.63 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.316 1.046 . . . . 0.0 113.04 176.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.66 -44.45 56.77 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.546 0.739 . . . . 0.0 110.484 173.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 15.3 mt -57.59 -41.26 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 CA-C-O 121.525 0.679 . . . . 0.0 111.533 173.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.46 -21.31 66.63 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -95.02 -23.12 17.5 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 176.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -90.64 -40.35 11.95 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 35.3 mt -83.81 179.7 7.51 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.776 2.031 . . . . 0.0 113.301 177.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 33.5 tp60 -91.43 -96.05 0.12 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.63 1.172 . . . . 0.0 112.167 -173.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.489 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 35.3 tt0 -140.85 -62.22 0.02 OUTLIER Pre-proline 0 N--CA 1.47 0.558 0 O-C-N 120.716 -1.24 . . . . 0.0 109.956 170.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.489 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 59.8 Cg_endo -65.57 -35.76 36.73 Favored 'Trans proline' 0 C--N 1.352 0.761 0 CA-C-N 121.276 1.491 . . . . 0.0 111.106 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -47.84 -47.74 31.25 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.999 1.319 . . . . 0.0 112.628 168.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -62.76 -48.03 80.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.965 1.306 . . . . 0.0 110.458 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.13 -34.77 74.43 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.568 1.08 . . . . 0.0 113.649 178.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -75.77 -33.48 60.2 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.483 1.142 . . . . 0.0 110.986 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.2 61.2 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.691 -0.63 . . . . 0.0 111.055 -174.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -67.05 -36.84 82.94 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.967 173.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.11 -55.18 35.45 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 119.378 0.99 . . . . 0.0 111.312 175.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 92.4 mt -53.79 -36.63 62.64 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.283 1.033 . . . . 0.0 111.847 174.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 40.9 ttp -67.2 -50.6 60.3 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.648 0.658 . . . . 0.0 112.353 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -64.58 -43.58 93.39 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.454 -0.778 . . . . 0.0 111.271 177.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -62.93 -39.09 93.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.604 1.562 . . . . 0.0 112.377 178.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -64.06 -39.99 95.28 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.167 -0.958 . . . . 0.0 111.985 173.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 83.9 mt -72.18 -35.07 51.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.233 1.013 . . . . 0.0 112.059 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 62.0 t0 -62.42 -62.59 1.65 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.07 2.148 . . . . 0.0 110.81 172.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -78.87 -1.21 33.96 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -177.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 23.0 ttmt -48.67 -45.13 38.4 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.715 1.206 . . . . 0.0 112.878 -173.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.05 161.93 39.5 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 127.841 2.456 . . . . 0.0 112.871 -178.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 56.08 34.3 23.53 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.679 1.192 . . . . 0.0 111.686 -177.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 24.9 mt . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 117.044 2.239 . . . . 0.0 117.044 175.95 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 73.2 m80 . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.6 tt -160.88 82.61 2.03 Favored Pre-proline 0 CA--C 1.558 1.276 0 C-N-CA 125.836 1.655 . . . . 0.0 110.759 172.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -79.46 131.24 9.39 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.231 2.621 . . . . 0.0 113.188 -175.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.4 p -56.09 -56.66 18.08 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -158.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.8 t -163.84 -174.75 3.77 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.934 1.294 . . . . 0.0 111.462 -175.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -63.68 -59.48 4.54 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.5 1.12 . . . . 0.0 111.579 173.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 50.3 mtt180 -147.8 130.04 15.59 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.517 1.927 . . . . 0.0 109.891 175.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.94 165.38 8.92 Favored Glycine 0 CA--C 1.538 1.504 0 C-N-CA 124.999 1.285 . . . . 0.0 114.935 -178.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 26.9 p -107.99 78.82 1.21 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.223 1.409 . . . . 0.0 110.652 175.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.8 m -131.21 133.71 45.76 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.344 1.058 . . . . 0.0 111.446 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -145.52 152.96 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 126.902 2.081 . . . . 0.0 108.786 171.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -85.02 -100.66 0.06 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.231 0.613 . . . . 0.0 110.437 175.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.58 29.03 33.78 Favored Glycine 0 CA--C 1.542 1.735 0 O-C-N 120.841 -1.162 . . . . 0.0 113.789 -176.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.3 t -76.21 34.77 0.13 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.816 1.246 . . . . 0.0 113.403 170.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -77.53 -176.02 4.07 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.917 1.287 . . . . 0.0 112.083 176.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.5 p -147.36 166.42 27.19 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 120.574 -1.328 . . . . 0.0 112.772 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 p -135.66 130.28 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.063 1.745 . . . . 0.0 111.379 -165.047 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -75.38 168.97 18.98 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.701 2.0 . . . . 0.0 112.548 172.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -50.29 -17.25 0.42 Allowed 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 -176.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.9 m -139.09 41.9 2.09 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 127.411 2.285 . . . . 0.0 111.674 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 92.38 -123.93 7.48 Favored Glycine 0 C--N 1.35 1.338 0 O-C-N 119.524 -1.985 . . . . 0.0 110.372 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 62.7 m-20 55.92 -178.94 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.584 1.153 . . . . 0.0 112.677 -171.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.48 114.84 28.22 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 172.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 12.1 mt -83.49 148.39 27.26 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 122.161 0.981 . . . . 0.0 111.951 175.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 22.9 mt -66.51 101.19 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.612 1.165 . . . . 0.0 110.089 -173.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -145.96 138.96 25.84 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.652 1.581 . . . . 0.0 110.086 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 34.5 ttp180 -78.29 42.35 0.41 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.119 1.368 . . . . 0.0 113.739 -170.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.33 -59.59 2.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.292 1.037 . . . . 0.0 113.317 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.0 pt -54.31 -31.3 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.426 1.49 . . . . 0.0 114.297 -167.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -60.09 -40.43 89.58 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.644 -0.66 . . . . 0.0 112.299 176.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -73.82 -32.39 63.68 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.52 0.728 . . . . 0.0 109.741 -173.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.1 mp -60.77 -51.01 71.16 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.619 0.767 . . . . 0.0 110.885 167.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.6 m-30 -60.17 -45.27 93.67 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 118.382 -0.818 . . . . 0.0 112.292 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -62.68 -38.05 88.83 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.536 1.134 . . . . 0.0 112.659 178.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.11 -41.29 97.3 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.206 0.912 . . . . 0.0 111.902 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -84.61 -28.24 26.65 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.571 -0.705 . . . . 0.0 112.665 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 43.8 mt -59.01 -33.29 70.55 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.643 1.11 . . . . 0.0 111.195 166.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.2 m -82.47 9.06 9.96 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.595 1.558 . . . . 0.0 113.952 175.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -149.4 38.8 0.79 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 126.042 1.737 . . . . 0.0 112.969 -174.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 9.1 p -141.2 3.39 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 C-N-CA 125.443 1.497 . . . . 0.0 113.891 -177.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -92.74 -20.16 35.06 Favored Glycine 0 CA--C 1.538 1.501 0 O-C-N 120.938 -1.101 . . . . 0.0 114.757 176.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -107.64 -32.44 7.67 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.734 1.214 . . . . 0.0 111.04 171.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -74.01 149.76 87.67 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 125.861 1.664 . . . . 0.0 114.045 -176.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -66.98 119.55 6.58 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.742 2.294 . . . . 0.0 111.438 171.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -51.61 -44.32 62.85 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 127.307 2.243 . . . . 0.0 111.895 -172.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -58.98 -39.84 82.98 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.973 1.309 . . . . 0.0 113.176 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -85.61 -36.11 20.56 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 121.595 -0.691 . . . . 0.0 111.884 -178.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 78.6 p -63.24 -41.48 99.08 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.119 178.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.29 -33.86 73.83 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.781 0.719 . . . . 0.0 112.493 176.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.79 -44.69 76.78 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.568 0.622 . . . . 0.0 111.956 -171.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 33.2 ptt180 -70.09 -32.68 70.86 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 118.625 -0.702 . . . . 0.0 112.881 171.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.4 tt -57.52 -60.38 3.75 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.966 0.803 . . . . 0.0 109.991 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.56 -31.92 66.6 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.804 0.841 . . . . 0.0 112.162 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.4 -37.52 80.41 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.118 0.567 . . . . 0.0 112.173 -177.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -61.18 -50.13 74.37 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.492 171.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.402 HD12 ' H ' ' A' ' 120' ' ' ILE . 4.3 mp -60.15 -39.49 80.68 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.413 0 CA-C-N 119.161 0.891 . . . . 0.0 111.578 177.119 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.85 -21.46 63.35 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -99.59 -21.38 15.9 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.73 1.212 . . . . 0.0 114.167 176.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -104.68 -38.12 6.83 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 120.357 -0.537 . . . . 0.0 112.237 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -87.67 156.63 19.38 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 122.491 1.139 . . . . 0.0 110.096 169.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.61 -88.47 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.944 0.898 . . . . 0.0 112.371 -166.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -150.07 -58.48 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.735 0 O-C-N 121.096 -1.003 . . . . 0.0 111.01 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -69.66 -36.24 11.43 Favored 'Trans proline' 0 C--N 1.353 0.776 0 CA-C-N 121.637 1.621 . . . . 0.0 111.113 167.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.97 -39.46 81.81 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 120.945 -1.097 . . . . 0.0 111.847 173.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 43.2 ttt180 -60.4 -51.24 70.33 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.211 1.405 . . . . 0.0 110.167 172.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -60.0 -31.02 71.32 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.018 1.294 . . . . 0.0 114.57 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.68 -30.23 41.05 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.768 1.284 . . . . 0.0 111.039 173.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.92 -44.3 55.51 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.414 -0.804 . . . . 0.0 111.138 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -66.99 -34.78 78.5 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 174.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.54 -56.36 22.27 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.003 0.521 . . . . 0.0 111.206 172.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.9 mp -58.45 -33.18 69.44 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.568 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 49.8 ttp -63.3 -48.21 79.03 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.708 0.803 . . . . 0.0 112.887 175.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -75.36 -29.54 59.94 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 120.761 -1.212 . . . . 0.0 112.775 176.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -69.13 -41.99 76.63 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 124.873 1.269 . . . . 0.0 110.703 -178.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -35.24 79.63 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.687 -0.633 . . . . 0.0 111.072 176.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 87.8 mt -65.77 -40.31 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.797 0.839 . . . . 0.0 110.952 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -60.01 -19.28 51.73 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.442 1.097 . . . . 0.0 113.918 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -118.77 3.84 11.6 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.414 1.485 . . . . 0.0 114.385 176.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 11.9 tppt? -71.12 -46.0 62.53 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.663 1.185 . . . . 0.0 112.234 -177.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -103.31 145.34 30.1 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.22 1.808 . . . . 0.0 112.013 -175.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -74.2 73.68 1.78 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 122.993 0.517 . . . . 0.0 112.266 176.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 68.1 mt . . . . . 0 CA--C 1.548 0.886 0 C-N-CA 125.981 1.712 . . . . 0.0 114.757 170.509 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 35.9 t-80 . . . . . 0 CA--C 1.545 0.769 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 11.5 tp 66.43 140.1 0.06 OUTLIER Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 127.896 2.478 . . . . 0.0 112.674 -169.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -63.54 117.97 4.91 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 CA-C-N 120.49 1.211 . . . . 0.0 109.076 162.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.6 p -123.33 137.3 54.87 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 121.604 0.716 . . . . 0.0 112.795 -178.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.1 m -119.3 49.31 1.36 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.557 1.943 . . . . 0.0 109.593 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -132.22 167.17 20.28 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.681 1.192 . . . . 0.0 111.166 -171.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 54.3 mtp85 -57.67 0.25 0.06 Allowed 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 118.194 2.664 . . . . 0.0 118.194 -169.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 56.46 37.65 75.94 Favored Glycine 0 N--CA 1.477 1.37 0 CA-C-N 120.159 1.345 . . . . 0.0 115.824 163.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 t -157.24 -177.81 6.89 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.389 1.475 . . . . 0.0 111.911 -169.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 80.2 p -64.46 145.38 56.18 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.516 1.527 . . . . 0.0 113.55 177.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.2 m -82.2 154.02 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 123.34 0.656 . . . . 0.0 112.244 167.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -73.86 64.0 0.94 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.13 2.172 . . . . 0.0 111.998 173.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -117.95 91.61 0.53 Allowed Glycine 0 CA--C 1.533 1.166 0 C-N-CA 125.658 1.599 . . . . 0.0 112.393 175.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.3 t -134.78 16.89 3.57 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 127.926 2.49 . . . . 0.0 113.864 -176.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -51.48 170.27 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 129.388 3.075 . . . . 0.0 115.517 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.6 p -107.52 162.89 13.53 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.449 1.5 . . . . 0.0 113.82 173.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.6 t -130.07 135.88 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.106 1.762 . . . . 0.0 109.728 -173.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -80.2 174.77 11.26 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.445 1.498 . . . . 0.0 112.406 177.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.52 -13.31 1.47 Allowed 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 116.279 1.955 . . . . 0.0 116.279 -172.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 9.4 m -151.7 54.54 0.84 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.12 1.768 . . . . 0.0 111.027 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.0 -120.8 5.4 Favored Glycine 0 CA--C 1.527 0.795 0 O-C-N 121.191 -0.943 . . . . 0.0 111.049 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 55.1 -178.81 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.107 0 CA-C-N 118.067 0.933 . . . . 0.0 112.329 -168.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -108.82 123.4 48.99 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.555 -1.341 . . . . 0.0 108.098 166.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.8 mt -87.08 147.79 25.53 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 120.253 1.388 . . . . 0.0 111.06 173.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 42.5 mm -67.67 95.93 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.495 1.118 . . . . 0.0 110.932 -176.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.7 p -136.2 142.78 44.13 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.085 1.354 . . . . 0.0 110.804 173.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.5 ttm180 -68.52 13.13 0.1 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.331 1.452 . . . . 0.0 114.805 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -62.88 -63.44 1.21 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.529 1.531 . . . . 0.0 112.495 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 45.7 pt -55.53 -26.88 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 126.236 1.814 . . . . 0.0 115.644 -169.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -65.79 -33.33 75.61 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.932 -1.105 . . . . 0.0 112.53 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -71.5 -35.44 70.77 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.527 0.731 . . . . 0.0 110.422 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tt -63.99 -49.46 72.4 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.059 1.344 . . . . 0.0 110.595 175.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -58.04 -46.83 84.71 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.047 -0.978 . . . . 0.0 113.154 170.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -64.43 -37.94 89.27 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 120.96 1.709 . . . . 0.0 112.148 -178.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.48 -41.51 89.93 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.473 -0.767 . . . . 0.0 112.361 176.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -89.26 -13.55 37.88 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 67.3 mt -74.64 -35.78 62.87 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.613 1.097 . . . . 0.0 111.455 163.16 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.9 t -67.53 -48.16 67.8 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.798 0.839 . . . . 0.0 111.39 170.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -93.02 30.33 1.64 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.739 1.216 . . . . 0.0 113.608 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.3 p -67.03 -26.8 37.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 -171.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 125.29 126.02 2.97 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 125.484 1.516 . . . . 0.0 113.884 171.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -67.83 -23.23 65.15 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.797 1.239 . . . . 0.0 113.717 173.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -154.52 -58.25 0.02 OUTLIER Pre-proline 0 CA--C 1.553 1.081 0 C-N-CA 126.449 1.899 . . . . 0.0 113.724 174.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -77.41 59.94 6.86 Favored 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 124.218 3.279 . . . . 0.0 114.392 -172.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.24 -25.36 61.6 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 126.294 1.838 . . . . 0.0 113.724 -174.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.42 -25.69 68.12 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 120.721 -1.237 . . . . 0.0 114.198 177.051 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -92.03 -34.99 14.19 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.561 1.073 . . . . 0.0 113.442 -174.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 66.2 p -61.24 -44.98 96.37 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.681 -0.637 . . . . 0.0 110.749 175.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -36.21 83.6 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.271 0.628 . . . . 0.0 112.089 176.283 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -63.43 -44.31 94.96 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.412 0.685 . . . . 0.0 111.442 -176.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -72.88 -42.39 63.7 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.496 0.718 . . . . 0.0 111.642 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.435 ' O ' HD12 ' A' ' 120' ' ' ILE . 57.3 tp -51.45 -59.93 3.7 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.909 0.883 . . . . 0.0 111.875 174.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.7 ppt_? -64.57 -20.95 66.55 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.03 -1.044 . . . . 0.0 113.526 -177.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -74.47 -45.84 43.5 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 124.123 0.889 . . . . 0.0 112.181 169.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -57.43 -50.9 71.53 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 118.962 0.801 . . . . 0.0 112.284 177.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.435 HD12 ' O ' ' A' ' 116' ' ' LEU . 4.0 mp -59.79 -41.78 86.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 119.587 1.085 . . . . 0.0 111.598 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.07 -32.8 73.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.41 33.06 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.179 -0.951 . . . . 0.0 110.645 175.114 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -71.61 -53.23 14.34 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.257 0.623 . . . . 0.0 112.303 -174.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.1 mt -81.1 166.54 20.61 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.162 0.506 . . . . 0.0 111.566 174.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -85.12 -87.46 0.12 Allowed 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -165.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.427 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 20.8 tt0 -143.02 -62.83 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.127 1.371 . . . . 0.0 109.782 169.232 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.427 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 63.2 Cg_endo -64.54 -37.23 39.03 Favored 'Trans proline' 0 C--N 1.356 0.926 0 CA-C-N 121.993 1.748 . . . . 0.0 112.27 177.063 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.04 -38.37 65.14 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.028 -1.045 . . . . 0.0 112.529 172.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -49.27 78.42 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.959 1.704 . . . . 0.0 110.557 176.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.8 -32.83 70.83 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 126.771 2.129 . . . . 0.0 114.32 175.052 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -78.26 -30.59 48.68 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.721 1.26 . . . . 0.0 110.909 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.76 -46.44 62.94 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.841 0.746 . . . . 0.0 111.306 -177.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.8 pp -64.9 -39.36 93.41 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.755 0.422 . . . . 0.0 111.898 174.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.62 -52.69 62.35 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.654 -0.654 . . . . 0.0 112.308 175.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.5 -29.45 69.09 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 117.877 -1.058 . . . . 0.0 111.817 176.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 46.3 ttp -66.65 -50.91 61.42 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.475 1.034 . . . . 0.0 111.771 174.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -67.68 -38.78 84.19 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.301 -0.874 . . . . 0.0 112.127 178.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -65.18 -41.21 94.84 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.988 1.315 . . . . 0.0 112.016 176.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -59.71 -37.51 79.08 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 121.331 -0.856 . . . . 0.0 111.503 172.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 84.1 mt -72.79 -40.98 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 123.834 0.854 . . . . 0.0 112.004 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -57.79 -51.12 70.88 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.528 1.131 . . . . 0.0 111.289 170.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 7.5 m-30 -89.13 11.38 18.75 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.384 1.074 . . . . 0.0 113.289 -176.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -65.29 -30.29 71.13 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.355 1.062 . . . . 0.0 112.358 178.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 36.2 pttt -159.03 150.11 20.14 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.247 1.819 . . . . 0.0 112.302 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -73.89 61.32 0.78 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.706 1.202 . . . . 0.0 111.478 168.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 7.0 mp . . . . . 0 CA--C 1.545 0.761 0 C-N-CA 128.961 2.904 . . . . 0.0 114.19 -170.005 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 23.5 m170 . . . . . 0 CA--C 1.544 0.742 0 CA-C-O 121.306 0.574 . . . . 0.0 111.717 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.57 87.35 3.39 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 124.359 1.064 . . . . 0.0 111.83 -179.269 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -74.53 -172.09 1.1 Allowed 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 123.96 3.107 . . . . 0.0 112.112 166.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 82.7 p -63.51 174.04 1.44 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 128.069 2.547 . . . . 0.0 116.069 -169.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.4 t 66.77 37.62 4.12 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 126.616 1.966 . . . . 0.0 115.197 -177.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 20.5 p90 -122.45 160.72 24.94 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.837 1.655 . . . . 0.0 111.557 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -165.51 162.56 19.3 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 127.041 2.136 . . . . 0.0 109.726 172.512 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -164.13 167.94 38.35 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 123.947 0.784 . . . . 0.0 112.999 -178.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 75.8 p -110.5 48.14 0.93 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.904 1.282 . . . . 0.0 112.963 -168.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 t 53.66 41.95 31.96 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.375 1.47 . . . . 0.0 114.315 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 24.0 m -89.91 172.67 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 125.492 1.517 . . . . 0.0 112.567 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -160.7 134.62 7.0 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.73 2.012 . . . . 0.0 107.489 171.202 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.91 76.66 0.07 OUTLIER Glycine 0 CA--C 1.53 1.017 0 C-N-CA 126.213 1.863 . . . . 0.0 113.427 172.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.6 t -75.92 27.61 0.11 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.892 1.677 . . . . 0.0 113.846 176.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -65.47 164.6 13.59 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.61 1.564 . . . . 0.0 112.205 177.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.7 p -120.36 156.15 31.93 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.702 1.201 . . . . 0.0 112.517 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.4 t -121.62 128.85 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 125.77 1.628 . . . . 0.0 108.624 -173.02 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -76.61 179.84 5.73 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.291 1.036 . . . . 0.0 112.636 176.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.73 -29.25 17.78 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 -168.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.3 m -143.55 84.85 1.82 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.654 1.582 . . . . 0.0 109.22 169.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 67.15 -124.3 22.63 Favored Glycine 0 CA--C 1.533 1.199 0 O-C-N 122.07 -0.394 . . . . 0.0 113.086 -177.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 57.31 178.92 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.858 1.263 . . . . 0.0 113.235 -168.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -113.05 125.76 54.74 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 164.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.6 mt -85.7 158.56 20.02 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 118.848 0.749 . . . . 0.0 110.228 169.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 39.8 mm -69.77 119.81 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.421 0.688 . . . . 0.0 110.437 179.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.7 p -147.46 162.16 39.6 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.733 0.813 . . . . 0.0 111.383 177.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -92.05 -19.79 21.98 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.922 -0.486 . . . . 0.0 111.815 -175.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.6 -29.5 37.98 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 173.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.0 mm -55.05 -34.93 33.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 O-C-N 120.794 -1.191 . . . . 0.0 111.433 -177.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -84.77 -18.67 34.33 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 121.171 -0.956 . . . . 0.0 111.613 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -73.77 -30.04 62.54 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.208 0.603 . . . . 0.0 110.501 173.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.8 mp -66.54 -57.01 8.18 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.428 0.558 . . . . 0.0 110.853 171.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -53.66 -46.55 70.63 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.346 177.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -60.66 -40.31 91.59 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.517 1.053 . . . . 0.0 112.715 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.41 -46.29 87.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.139 -0.975 . . . . 0.0 112.333 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -78.78 -21.12 48.3 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.0 mt -69.05 -37.1 78.37 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 119.439 1.018 . . . . 0.0 112.574 171.078 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.0 t -71.57 -37.21 71.06 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 119.152 0.887 . . . . 0.0 112.154 171.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -81.9 2.92 28.25 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 177.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 9.9 p -60.7 -29.45 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 116.265 1.95 . . . . 0.0 116.265 -155.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 102.54 171.15 26.81 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 124.501 1.048 . . . . 0.0 114.797 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -147.2 -58.28 0.27 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.417 1.487 . . . . 0.0 110.745 -176.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -80.52 -62.97 0.36 Allowed Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 123.527 0.731 . . . . 0.0 111.814 167.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -74.88 141.34 26.89 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.676 2.251 . . . . 0.0 110.348 168.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -141.06 -41.56 0.39 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.629 1.171 . . . . 0.0 110.356 177.405 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -54.63 -40.33 68.84 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.695 1.198 . . . . 0.0 112.769 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 28.6 mp0 -72.16 -43.4 64.68 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.002 -1.061 . . . . 0.0 113.048 178.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 28.0 t -54.77 -49.65 70.38 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.853 0.861 . . . . 0.0 110.614 175.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.97 -37.58 72.78 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 117.578 -1.201 . . . . 0.0 112.752 178.035 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -57.96 -51.07 71.17 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 120.125 1.329 . . . . 0.0 110.633 178.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -72.77 -37.6 67.57 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 117.998 -1.001 . . . . 0.0 111.577 -176.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 52.3 tp -54.98 -63.67 1.08 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.524 0.73 . . . . 0.0 111.558 173.076 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.76 -22.28 66.83 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 117.523 -1.227 . . . . 0.0 113.427 -177.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.92 -44.71 54.23 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 124.21 0.944 . . . . 0.0 112.287 168.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -53.17 -50.53 64.4 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.75 1.22 . . . . 0.0 112.315 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.0 mp -60.72 -39.37 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 O-C-N 121.63 -0.669 . . . . 0.0 111.955 177.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -75.2 -15.95 60.52 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -98.57 -35.39 10.23 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.127 1.371 . . . . 0.0 113.296 175.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -82.91 -39.41 21.53 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.917 0.887 . . . . 0.0 112.214 175.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 83.6 mt -93.95 168.32 11.04 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.387 1.089 . . . . 0.0 112.285 168.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.9 -91.35 0.09 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.63 1.172 . . . . 0.0 112.31 -164.238 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.444 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 19.5 tt0 -146.07 -55.12 0.02 OUTLIER Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.932 1.293 . . . . 0.0 111.281 173.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.444 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 57.6 Cg_endo -68.34 -43.32 4.49 Favored 'Trans proline' 0 C--N 1.356 0.949 0 CA-C-N 121.921 1.722 . . . . 0.0 111.726 173.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -48.92 -39.47 26.27 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.648 1.579 . . . . 0.0 113.142 173.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.87 -45.13 95.79 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.183 1.393 . . . . 0.0 111.355 176.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.95 -35.17 82.11 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 125.485 1.517 . . . . 0.0 113.707 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -73.73 -32.92 64.1 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.362 1.081 . . . . 0.0 110.68 174.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.09 -45.0 62.35 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.173 0.589 . . . . 0.0 111.565 -176.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.07 -37.06 80.84 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.338 0.655 . . . . 0.0 112.259 175.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.9 -51.51 66.67 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.304 0.502 . . . . 0.0 112.012 173.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.7 mp -58.37 -30.1 66.52 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 117.874 -1.06 . . . . 0.0 111.646 175.039 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.432 ' SD ' HD11 ' A' ' 140' ' ' ILE . 0.0 OUTLIER -63.78 -57.36 10.17 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.067 0.848 . . . . 0.0 111.483 175.682 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -66.72 -37.24 84.29 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.215 -0.928 . . . . 0.0 112.395 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -62.8 -38.95 92.71 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.189 1.396 . . . . 0.0 112.203 173.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -65.32 -43.19 91.81 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.368 -0.832 . . . . 0.0 111.27 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 136' ' ' MET . 55.6 mt -62.43 -38.76 82.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-O 118.406 -0.807 . . . . 0.0 112.419 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -57.2 -23.05 45.17 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.963 0.905 . . . . 0.0 112.786 175.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -118.1 6.6 12.08 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.381 1.472 . . . . 0.0 114.455 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -79.61 -17.41 53.91 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.64 1.176 . . . . 0.0 113.857 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -96.95 137.07 36.6 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.987 1.315 . . . . 0.0 109.545 173.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -73.45 91.24 1.76 Allowed 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.419 -0.801 . . . . 0.0 110.946 177.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 9.3 mp . . . . . 0 N--CA 1.477 0.884 0 C-N-CA 128.484 2.713 . . . . 0.0 116.898 169.872 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 . . . . . 0 CA--C 1.556 1.182 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 25.6 tp -128.59 74.52 80.24 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 125.878 1.671 . . . . 0.0 112.096 -168.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -80.68 -31.15 1.58 Allowed 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 123.114 2.543 . . . . 0.0 113.578 178.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 22.2 p -92.66 116.44 29.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.987 1.315 . . . . 0.0 112.133 -173.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.6 m -136.94 154.69 50.38 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.147 1.779 . . . . 0.0 111.349 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -59.95 109.8 1.03 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.442 1.097 . . . . 0.0 113.207 -172.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 55.48 22.48 5.1 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 125.585 1.554 . . . . 0.0 113.005 -174.038 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 107.46 -164.3 13.05 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 125.175 1.369 . . . . 0.0 112.986 -173.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.5 p -91.33 17.66 8.12 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.835 1.654 . . . . 0.0 114.208 -175.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.5 m -77.23 54.25 1.08 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 126.235 1.814 . . . . 0.0 115.507 -170.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.3 m -93.85 144.3 9.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 124.432 1.093 . . . . 0.0 111.751 171.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -67.12 -43.18 83.1 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 121.443 -0.786 . . . . 0.0 112.449 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.17 39.76 81.91 Favored Glycine 0 N--CA 1.475 1.236 0 C-N-CA 124.969 1.271 . . . . 0.0 114.356 171.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.4 t -139.72 55.53 1.66 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.785 1.279 . . . . 0.0 109.71 -152.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -95.6 161.19 14.15 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 127.399 2.279 . . . . 0.0 112.228 177.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 p -92.23 155.35 18.04 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.597 1.559 . . . . 0.0 113.259 171.111 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 27.7 m -131.75 159.48 43.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 125.998 1.719 . . . . 0.0 110.438 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -91.35 -178.95 5.27 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.043 1.737 . . . . 0.0 112.715 -177.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.72 15.62 0.1 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.113 1.765 . . . . 0.0 115.528 -173.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.5 m -160.49 38.93 0.17 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.966 2.107 . . . . 0.0 110.547 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.69 -122.51 7.16 Favored Glycine 0 CA--C 1.529 0.961 0 O-C-N 121.035 -1.041 . . . . 0.0 110.981 -166.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 57.07 -174.9 0.07 Allowed 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 118.182 0.991 . . . . 0.0 112.996 -171.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 87' ' ' LEU . 4.2 mt -108.58 134.56 51.17 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.942 0.897 . . . . 0.0 108.985 171.454 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.7 164.3 12.64 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.715 0.806 . . . . 0.0 111.374 175.017 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 39.3 mm -66.43 108.86 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.025 0.93 . . . . 0.0 111.231 175.37 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 10.1 t -155.93 162.96 40.31 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.838 1.255 . . . . 0.0 111.675 170.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -94.26 9.09 39.42 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -57.03 -46.14 82.62 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 121.156 -0.965 . . . . 0.0 111.981 172.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.5 pt -56.46 -33.33 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.519 1.128 . . . . 0.0 113.622 178.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 40.0 ttt85 -61.33 -45.1 95.84 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 118.696 0.68 . . . . 0.0 110.706 173.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -68.01 -33.4 74.55 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.153 0.581 . . . . 0.0 111.334 -178.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.3 mp -62.82 -52.56 62.68 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.843 0.747 . . . . 0.0 112.017 168.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.71 -42.9 98.16 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.306 0.957 . . . . 0.0 112.749 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -62.94 -43.88 97.6 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.526 1.057 . . . . 0.0 111.717 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.81 -36.72 79.78 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -90.2 -24.77 20.91 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 31.6 mt -63.59 -44.63 93.46 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 119.308 0.958 . . . . 0.0 111.544 173.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.9 t -72.95 -26.41 61.37 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.65 -11.8 61.13 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 115.887 1.81 . . . . 0.0 115.887 -177.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 8.0 p -67.46 -38.97 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 119.793 1.178 . . . . 0.0 114.062 -172.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 56.01 -132.96 50.84 Favored Glycine 0 CA--C 1.538 1.514 0 O-C-N 121.702 -0.624 . . . . 0.0 112.803 -174.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -105.89 -2.35 23.09 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 124.725 1.21 . . . . 0.0 113.687 172.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -70.71 153.43 94.9 Favored Pre-proline 0 CA--C 1.543 0.673 0 C-N-CA 125.096 1.358 . . . . 0.0 111.536 178.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -64.57 115.75 3.39 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 121.851 1.701 . . . . 0.0 112.08 -173.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.1 tt -50.97 -28.59 10.18 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.43 1.892 . . . . 0.0 112.483 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -48.33 -29.63 4.12 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.701 1.6 . . . . 0.0 113.979 171.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -89.64 -40.18 12.74 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 176.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 89.1 p -68.05 -37.12 80.95 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 121.289 -0.882 . . . . 0.0 111.506 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.5 pp -65.09 -34.17 77.77 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 118.996 -0.526 . . . . 0.0 111.886 173.095 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -64.92 -45.39 86.04 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.265 0.555 . . . . 0.0 111.816 -175.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 18.3 mmt85 -64.2 -43.62 94.46 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.112 0.565 . . . . 0.0 110.721 171.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.452 ' O ' HD12 ' A' ' 120' ' ' ILE . 54.8 tp -56.1 -56.16 24.18 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.434 0.694 . . . . 0.0 112.153 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -55.77 -37.01 67.98 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 119.256 0.935 . . . . 0.0 112.285 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.71 -41.35 92.41 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.807 0.843 . . . . 0.0 112.431 178.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -61.58 -49.04 78.26 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 118.558 -0.734 . . . . 0.0 111.958 173.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.452 HD12 ' O ' ' A' ' 116' ' ' LEU . 3.5 mp -57.94 -45.81 87.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.794 1.179 . . . . 0.0 111.195 175.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.84 -32.96 74.9 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -80.64 -45.77 16.7 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.997 0.817 . . . . 0.0 112.708 177.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -66.0 -51.87 54.44 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.993 1.317 . . . . 0.0 112.985 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.508 HD12 ' HB1' ' A' ' 128' ' ' ALA . 3.7 mm? -75.9 -160.92 0.15 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.836 1.255 . . . . 0.0 112.102 -178.302 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.54 -105.48 0.39 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.08 1.352 . . . . 0.0 109.239 173.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.405 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 56.7 tt0 -127.54 -64.38 0.02 OUTLIER Pre-proline 0 N--CA 1.468 0.464 0 O-C-N 120.126 -1.609 . . . . 0.0 110.162 -176.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.405 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 77.6 Cg_endo -67.08 -30.95 37.8 Favored 'Trans proline' 0 C--N 1.349 0.574 0 CA-C-N 121.206 1.467 . . . . 0.0 111.561 173.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.508 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -63.6 -35.41 80.41 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 120.794 -1.191 . . . . 0.0 112.267 172.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -64.55 -47.3 79.3 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.971 0.908 . . . . 0.0 110.125 170.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.8 -34.54 78.1 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.138 1.352 . . . . 0.0 114.008 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -33.15 64.84 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.812 1.306 . . . . 0.0 110.041 175.324 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.38 -43.42 60.62 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.372 0.669 . . . . 0.0 111.558 -174.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -69.49 -35.54 75.67 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.094 0.557 . . . . 0.0 112.439 174.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.84 -50.51 70.65 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 122.937 0.495 . . . . 0.0 111.923 172.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.7 mp -57.79 -31.98 67.1 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 117.619 -1.182 . . . . 0.0 111.916 173.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 2.3 tpt -64.53 -52.32 58.34 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.611 1.096 . . . . 0.0 111.137 174.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 38.3 mm-40 -62.4 -43.08 99.66 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.104 0.562 . . . . 0.0 112.46 177.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -41.82 86.23 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.64 1.176 . . . . 0.0 111.985 -179.405 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -60.88 -42.68 98.4 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.852 0.751 . . . . 0.0 111.332 170.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 68.3 mt -62.5 -28.74 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-O 119.182 -0.437 . . . . 0.0 111.089 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -76.9 -31.21 56.57 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.656 -176.52 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.3 p90 -102.55 3.31 37.28 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 174.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 9.9 ttpt -54.17 -29.24 44.86 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.465 1.506 . . . . 0.0 113.585 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.75 148.21 28.96 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.125 1.37 . . . . 0.0 112.546 169.688 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -74.6 39.2 0.12 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 124.906 1.282 . . . . 0.0 112.32 165.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 7.3 mp . . . . . 0 N--CA 1.475 0.793 0 C-N-CA 129.966 3.307 . . . . 0.0 115.553 -167.322 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 21.6 m80 . . . . . 0 CA--C 1.539 0.549 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 39.5 mt -141.01 63.31 18.25 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.12 1.368 . . . . 0.0 111.272 171.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -61.78 140.21 84.53 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 122.373 2.049 . . . . 0.0 111.36 175.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.4 p -75.64 18.52 0.23 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.58 1.952 . . . . 0.0 115.46 -164.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 73.9 m -71.66 85.15 0.89 Allowed 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.87 -1.144 . . . . 0.0 110.942 177.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -158.58 30.61 0.23 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.539 1.135 . . . . 0.0 113.004 -176.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.9 mmt85 59.48 -14.64 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 118.173 2.656 . . . . 0.0 118.173 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 126.8 109.74 1.63 Allowed Glycine 0 CA--C 1.53 1.018 0 C-N-CA 127.109 2.29 . . . . 0.0 110.765 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.1 p -60.02 -46.83 88.2 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -154.128 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.2 m 54.66 13.96 0.78 Allowed 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 16.7 m -64.35 151.58 9.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 126.521 1.928 . . . . 0.0 113.808 -171.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -77.22 -57.1 4.02 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 61.48 17.54 53.6 Favored Glycine 0 CA--C 1.541 1.718 0 C-N-CA 124.534 1.064 . . . . 0.0 115.73 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.6 t -79.83 28.74 0.27 Allowed 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.583 1.553 . . . . 0.0 114.308 -175.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -67.66 161.88 24.88 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.803 1.241 . . . . 0.0 112.788 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 73.4 p -147.52 163.17 37.41 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.958 0.903 . . . . 0.0 113.201 -178.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.8 p -127.99 130.2 69.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.675 1.59 . . . . 0.0 111.975 -167.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -82.75 178.9 7.96 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.653 1.581 . . . . 0.0 113.336 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.43 -7.01 0.2 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.483 2.313 . . . . 0.0 117.203 -173.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.3 m -161.53 75.84 0.5 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 126.041 1.736 . . . . 0.0 109.864 161.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 73.58 -127.3 10.47 Favored Glycine 0 CA--C 1.528 0.874 0 O-C-N 121.169 -0.957 . . . . 0.0 110.939 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.8 m120 57.84 175.95 0.05 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.357 1.063 . . . . 0.0 111.372 -166.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.4 125.84 52.2 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.629 -1.294 . . . . 0.0 108.26 167.169 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.9 mt -84.29 166.33 17.56 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 118.925 0.784 . . . . 0.0 111.959 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 38.2 mm -73.49 94.96 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 124.583 1.153 . . . . 0.0 112.127 -173.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 46.3 p -138.03 148.05 44.74 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.933 1.693 . . . . 0.0 111.58 177.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.31 6.04 48.33 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -174.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -59.48 -39.01 82.37 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.979 0.912 . . . . 0.0 110.906 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 32.8 pt -55.53 -37.09 44.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 125.792 1.637 . . . . 0.0 113.356 176.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 -61.18 -55.22 34.73 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.238 1.015 . . . . 0.0 109.888 176.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -66.48 -31.81 72.78 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.534 0.733 . . . . 0.0 112.305 -179.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 8.7 mt -62.51 -53.4 55.26 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.165 0.986 . . . . 0.0 112.497 172.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -59.8 -46.24 89.83 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.68 0.673 . . . . 0.0 110.867 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -65.16 -34.17 77.74 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -177.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.02 -44.7 79.62 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.149 -0.97 . . . . 0.0 112.664 173.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -74.62 -31.22 61.93 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.495 -0.753 . . . . 0.0 112.293 179.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.0 mt -63.49 -39.84 95.5 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.814 0.734 . . . . 0.0 110.465 169.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 34.1 m -67.74 -3.17 8.51 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 172.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -112.46 0.5 15.58 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.794 1.638 . . . . 0.0 113.606 172.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.3 p -66.8 -11.8 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 -168.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -59.99 -68.26 1.76 Allowed Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.335 1.445 . . . . 0.0 113.434 -178.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -67.64 169.67 9.03 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 118.149 0.975 . . . . 0.0 111.396 172.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 57.37 153.44 0.08 OUTLIER Pre-proline 0 N--CA 1.49 1.553 0 C-N-CA 127.328 2.251 . . . . 0.0 117.0 -173.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -69.3 144.63 57.14 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 121.815 1.677 . . . . 0.0 110.534 163.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -49.12 -41.67 36.69 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.601 1.16 . . . . 0.0 112.662 -178.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -58.99 -29.96 67.61 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.74 1.216 . . . . 0.0 113.688 -178.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -85.04 -43.35 14.01 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.01 0.823 . . . . 0.0 111.968 178.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 48.1 t -59.72 -43.15 94.3 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 123.767 0.827 . . . . 0.0 111.343 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.3 pp -68.91 -35.46 76.86 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.605 -0.712 . . . . 0.0 112.307 174.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.78 -45.81 92.28 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.379 0.991 . . . . 0.0 110.637 178.336 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -57.63 -45.16 85.76 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.872 0.869 . . . . 0.0 111.642 174.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 38.7 tp -62.65 -56.57 16.56 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.515 0.726 . . . . 0.0 112.461 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -22.52 65.54 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.179 -0.951 . . . . 0.0 113.328 -177.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -72.64 -40.17 66.61 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.137 0.975 . . . . 0.0 113.126 174.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -42.9 74.06 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.647 0.658 . . . . 0.0 110.486 177.144 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 17.8 mt -57.06 -40.97 76.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 121.575 -0.703 . . . . 0.0 110.955 173.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.85 -23.15 64.2 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -79.34 -29.63 42.33 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 174.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -107.37 -37.5 6.21 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -170.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -88.51 156.72 18.93 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.291 1.436 . . . . 0.0 111.664 175.301 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -75.98 -69.03 0.52 Allowed 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 -157.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -165.21 -56.82 0.01 OUTLIER Pre-proline 0 N--CA 1.479 0.985 0 C-N-CA 127.147 2.179 . . . . 0.0 109.794 168.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -69.78 -39.69 6.16 Favored 'Trans proline' 0 C--N 1.356 0.927 0 CA-C-N 121.446 1.552 . . . . 0.0 111.498 173.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.34 -40.26 61.72 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.75 1.22 . . . . 0.0 112.35 175.154 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -60.23 -48.36 82.04 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.493 1.517 . . . . 0.0 111.163 174.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.52 -34.05 74.23 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.52 1.533 . . . . 0.0 113.625 177.505 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -73.83 -34.46 64.56 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.437 1.118 . . . . 0.0 110.906 175.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.78 -46.61 68.29 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 122.876 0.47 . . . . 0.0 110.902 -176.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -71.08 -33.57 70.33 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 175.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.17 -53.02 59.82 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 118.826 0.739 . . . . 0.0 112.257 173.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.16 -34.22 70.06 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.673 0.789 . . . . 0.0 111.242 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 48.3 ttp -64.93 -52.93 53.68 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.601 0.761 . . . . 0.0 112.37 175.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -64.81 -37.64 88.3 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.587 -0.696 . . . . 0.0 112.428 178.086 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -64.35 -43.35 94.85 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.344 1.058 . . . . 0.0 112.309 175.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' TYR . . . . . 0.437 ' O ' ' HE2' ' A' ' 143' ' ' LYS . 73.4 t80 -59.93 -39.47 85.6 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.44 -0.788 . . . . 0.0 111.465 175.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 88.3 mt -72.16 -41.87 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.079 1.351 . . . . 0.0 112.867 176.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -55.0 -53.24 58.26 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.134 1.374 . . . . 0.0 110.028 172.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -79.52 7.93 7.29 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 120.935 -1.103 . . . . 0.0 113.231 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.437 ' HE2' ' O ' ' A' ' 139' ' ' TYR . 0.0 OUTLIER -78.62 -29.63 46.03 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.093 0.957 . . . . 0.0 112.679 166.77 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -85.16 141.58 30.08 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.54 1.136 . . . . 0.0 112.373 178.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -98.11 13.76 29.93 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.564 1.546 . . . . 0.0 114.228 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 28.7 mt . . . . . 0 N--CA 1.482 1.151 0 C-N-CA 128.138 2.575 . . . . 0.0 116.444 179.713 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 . . . . . 0 CA--C 1.537 0.479 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -115.5 150.35 44.48 Favored Pre-proline 0 N--CA 1.476 0.856 0 C-N-CA 124.509 1.124 . . . . 0.0 111.958 -175.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -79.24 -10.21 15.01 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 122.903 2.402 . . . . 0.0 115.281 -173.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.1 t -127.25 156.1 42.42 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.85 1.26 . . . . 0.0 112.995 -167.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 77.2 p -90.34 -166.69 1.64 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.11 1.364 . . . . 0.0 113.422 -173.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -139.75 157.38 45.84 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.367 1.867 . . . . 0.0 109.635 178.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -82.44 151.08 26.72 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 172.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -76.1 49.61 2.58 Favored Glycine 0 CA--C 1.535 1.314 0 N-CA-C 116.085 1.194 . . . . 0.0 116.085 -171.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.1 t -88.57 139.65 30.26 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.928 1.291 . . . . 0.0 112.615 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.2 p -84.01 87.49 7.13 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.003 1.321 . . . . 0.0 111.681 179.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.4 131.46 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-O 121.418 0.628 . . . . 0.0 111.404 172.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -74.6 -47.16 33.94 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.664 1.585 . . . . 0.0 112.51 -178.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 65.65 35.32 90.93 Favored Glycine 0 CA--C 1.541 1.691 0 CA-C-O 118.461 -1.189 . . . . 0.0 113.308 -172.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.8 t -112.59 131.31 55.68 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.333 1.453 . . . . 0.0 113.385 -166.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -169.79 178.09 4.19 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.217 1.807 . . . . 0.0 110.4 -176.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 53.9 p -137.11 159.67 41.21 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.739 1.216 . . . . 0.0 112.644 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.0 p -128.33 130.92 69.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 126.52 1.928 . . . . 0.0 111.52 -169.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -77.95 170.03 17.28 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 126.203 1.801 . . . . 0.0 111.644 173.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.34 -1.79 0.15 Allowed 'General case' 0 CA--C 1.558 1.265 0 N-CA-C 117.071 2.248 . . . . 0.0 117.071 -173.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 18.0 m -147.38 39.42 0.99 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.534 1.933 . . . . 0.0 112.094 175.252 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 86.94 -121.15 5.69 Favored Glycine 0 C--N 1.342 0.913 0 N-CA-C 109.951 -1.259 . . . . 0.0 109.951 -173.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 20.4 m120 57.37 175.47 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.091 0.956 . . . . 0.0 112.764 -166.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.44 120.55 42.21 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 164.503 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.0 mt -84.15 161.0 20.76 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.14 0.882 . . . . 0.0 110.922 170.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 17.9 mt -75.17 99.08 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 124.301 1.04 . . . . 0.0 110.888 -173.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 31.9 p -113.18 155.48 24.94 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.842 0.857 . . . . 0.0 110.595 162.56 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.521 ' O ' ' HG2' ' A' ' 94' ' ' ARG . 1.5 tpm_? -72.02 -33.08 67.76 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.206 -0.934 . . . . 0.0 111.469 173.353 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -53.36 -34.55 58.02 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 127.198 2.199 . . . . 0.0 113.447 -167.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 55.3 mt -44.38 -35.97 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 126.424 1.89 . . . . 0.0 112.782 173.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 91' ' ' ARG . 19.9 ptt85 -79.9 -24.92 40.8 Favored 'General case' 0 C--N 1.339 0.137 0 O-C-N 121.494 -0.754 . . . . 0.0 111.829 -173.221 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -73.61 -30.73 63.17 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.175 0.99 . . . . 0.0 110.019 175.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.4 -45.09 89.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.738 0.815 . . . . 0.0 111.425 172.073 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -60.99 -47.96 84.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 118.127 -0.94 . . . . 0.0 112.715 170.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.7 -41.67 97.9 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 120.355 1.434 . . . . 0.0 112.148 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.24 -22.68 63.33 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 177.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -106.31 -22.49 12.81 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.3 mt -64.05 -51.16 65.43 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.977 1.262 . . . . 0.0 109.833 171.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.8 m -71.21 8.34 1.02 Allowed 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 172.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -134.58 14.99 3.7 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.876 1.27 . . . . 0.0 113.716 176.411 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.492 HG13 ' H ' ' A' ' 106' ' ' GLU . 8.4 p -76.87 -25.02 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.372 1.069 . . . . 0.0 113.503 -178.692 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.8 -10.31 19.34 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 124.922 1.248 . . . . 0.0 115.874 -179.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.492 ' H ' HG13 ' A' ' 104' ' ' VAL . 27.0 mm-40 62.49 -24.51 0.05 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 128.596 2.758 . . . . 0.0 117.202 175.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -105.89 -43.59 0.15 Allowed Pre-proline 0 CA--C 1.561 1.381 0 C-N-CA 125.116 1.366 . . . . 0.0 114.629 169.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -84.01 67.99 6.81 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.186 3.257 . . . . 0.0 112.825 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.68 8.73 1.05 Allowed 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -174.642 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -94.72 -69.8 0.74 Allowed 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.219 -1.55 . . . . 0.0 112.089 -178.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -70.36 -19.04 63.07 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 120.136 -1.602 . . . . 0.0 114.201 -171.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.0 p -65.13 -44.18 89.5 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 124.378 1.071 . . . . 0.0 111.63 171.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.8 -36.87 67.66 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 118.45 0.568 . . . . 0.0 111.88 175.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -63.65 -42.95 98.06 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.413 0.551 . . . . 0.0 112.067 -169.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 38.8 ptt85 -73.5 -32.37 64.24 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 172.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 43.9 tp -65.23 -58.26 6.4 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.998 0.817 . . . . 0.0 111.013 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.85 -30.81 67.98 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.334 -0.854 . . . . 0.0 112.017 178.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.97 -44.05 81.47 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 122.89 0.476 . . . . 0.0 111.988 174.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -53.36 -56.4 17.03 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.341 1.057 . . . . 0.0 112.049 173.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.404 HD12 ' H ' ' A' ' 120' ' ' ILE . 4.2 mp -60.54 -41.03 86.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 121.637 -0.664 . . . . 0.0 111.562 177.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.18 -24.22 64.94 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.31 -33.2 16.19 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.96 0.904 . . . . 0.0 113.062 173.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.54 -48.84 14.43 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.397 1.479 . . . . 0.0 113.342 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -92.36 155.15 18.1 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.66 1.584 . . . . 0.0 111.049 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -76.42 -74.16 0.24 Allowed 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 114.967 -1.015 . . . . 0.0 113.47 -159.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -158.12 -58.43 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.704 0 C-N-CA 125.102 1.361 . . . . 0.0 110.377 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -70.16 -41.22 3.94 Favored 'Trans proline' 0 C--N 1.353 0.81 0 CA-C-N 121.047 1.41 . . . . 0.0 111.321 171.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.25 -37.47 67.26 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.926 1.29 . . . . 0.0 113.12 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 20.1 ttt-85 -56.59 -50.93 70.52 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.253 1.821 . . . . 0.0 111.104 172.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.72 -30.54 62.8 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.408 1.48 . . . . 0.0 114.376 177.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -80.77 -30.6 36.0 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.412 1.106 . . . . 0.0 111.598 173.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.55 -45.9 64.59 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.635 -0.666 . . . . 0.0 111.043 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -66.34 -34.46 78.03 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.253 0.621 . . . . 0.0 112.638 174.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.0 -54.38 35.26 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.123 0.569 . . . . 0.0 112.124 173.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 65.7 mt -55.31 -38.17 68.34 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.673 0.789 . . . . 0.0 111.051 178.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 60.1 ttp -63.43 -53.79 46.68 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.068 0.947 . . . . 0.0 112.014 177.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -69.71 -32.24 70.71 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.009 -1.057 . . . . 0.0 113.258 -178.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -61.56 -45.13 95.43 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.679 1.192 . . . . 0.0 110.932 169.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -61.81 -45.08 95.4 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.155 -0.965 . . . . 0.0 111.639 174.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 71.1 mt -61.66 -38.41 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.173 0.989 . . . . 0.0 112.076 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -58.11 -54.74 43.49 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.373 1.469 . . . . 0.0 111.471 173.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -86.01 1.23 51.03 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 120.122 -1.611 . . . . 0.0 113.04 -174.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -54.7 -50.67 67.74 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.22 1.008 . . . . 0.0 110.424 173.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -59.99 161.49 6.63 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.105 1.362 . . . . 0.0 112.946 175.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.85 86.59 2.49 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.812 0.815 . . . . 0.0 112.212 -176.185 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 41.5 mt . . . . . 0 N--CA 1.48 1.035 0 C-N-CA 127.083 2.153 . . . . 0.0 116.649 174.056 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 33.2 m170 . . . . . 0 CA--C 1.544 0.75 0 CA-C-O 120.497 0.189 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 mp 64.5 160.29 0.12 Allowed Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 127.984 2.514 . . . . 0.0 115.955 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -78.42 -45.38 0.13 Allowed 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 123.022 2.482 . . . . 0.0 113.192 178.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.6 p -154.43 151.05 28.54 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 127.185 2.194 . . . . 0.0 109.811 178.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.8 t -79.37 -177.97 6.01 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 122.933 0.493 . . . . 0.0 111.382 169.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -81.28 172.49 13.54 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.321 1.048 . . . . 0.0 113.264 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 71' ' ' ARG . 21.3 ttt180 -125.75 154.72 42.1 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.294 176.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.33 -164.0 31.74 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 115.968 -0.56 . . . . 0.0 113.684 -173.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.1 t -142.82 -4.55 0.94 Allowed 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.8 m -82.9 58.3 4.28 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.936 1.694 . . . . 0.0 113.393 -170.139 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 23.0 m -111.16 160.48 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 124.797 1.239 . . . . 0.0 111.62 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -106.62 -69.36 0.84 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.17 0.15 14.35 Favored Glycine 0 CA--C 1.539 1.564 0 N-CA-C 117.625 1.81 . . . . 0.0 117.625 168.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.3 t -117.4 51.54 1.02 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.485 1.642 . . . . 0.0 112.34 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -68.71 168.64 12.81 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.039 1.336 . . . . 0.0 114.205 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.1 p -84.68 162.59 19.64 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.369 1.468 . . . . 0.0 114.032 176.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.3 p -145.28 140.63 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 125.254 1.422 . . . . 0.0 111.122 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -80.96 174.65 11.41 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.459 1.904 . . . . 0.0 111.881 175.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.94 -6.94 0.64 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.71 2.004 . . . . 0.0 115.791 -177.084 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 26.9 m -156.87 59.34 0.53 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.56 1.944 . . . . 0.0 110.758 169.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.11 -115.98 4.22 Favored Glycine 0 C--N 1.341 0.85 0 O-C-N 121.18 -0.95 . . . . 0.0 111.482 178.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 128' ' ' ALA . 28.5 m-20 52.36 -177.03 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.748 1.619 . . . . 0.0 113.006 -174.762 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 87' ' ' LEU . 1.4 mt -114.6 119.46 36.84 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 120.342 -1.474 . . . . 0.0 109.777 167.32 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.8 mt -85.04 149.19 25.75 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.632 0.773 . . . . 0.0 110.246 172.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 15.0 mt -81.77 112.45 19.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 123.525 0.73 . . . . 0.0 110.137 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 6.4 t -155.0 176.51 12.44 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.3 1.04 . . . . 0.0 112.202 169.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -68.31 -15.15 63.46 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -165.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.17 -32.41 73.79 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.751 1.159 . . . . 0.0 112.234 -177.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.7 mt -63.51 -36.47 76.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.384 0.673 . . . . 0.0 111.743 -170.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -59.67 -52.02 67.29 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.619 -0.676 . . . . 0.0 110.494 170.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -62.43 -30.63 71.37 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.32 1.048 . . . . 0.0 112.296 -179.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -53.51 56.39 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.087 0.955 . . . . 0.0 111.759 174.067 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -65.62 -43.23 90.19 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.373 176.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -40.06 89.7 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.338 0.972 . . . . 0.0 112.167 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.92 -38.18 84.86 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.51 -0.744 . . . . 0.0 112.586 -178.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -93.28 -21.11 19.79 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 32.1 mt -66.35 -23.35 66.33 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.58 1.082 . . . . 0.0 113.489 173.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 41.6 t -76.36 -39.71 53.12 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 121.719 -0.613 . . . . 0.0 112.44 164.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -77.1 33.39 0.15 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.546 1.938 . . . . 0.0 114.416 -176.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 3.0 p -135.86 1.56 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 126.398 1.879 . . . . 0.0 113.618 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -85.55 -59.56 1.9 Allowed Glycine 0 CA--C 1.531 1.082 0 O-C-N 121.074 -1.016 . . . . 0.0 113.132 173.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -82.67 -18.69 40.13 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -179.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.11 142.69 25.57 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 125.902 1.681 . . . . 0.0 110.713 175.601 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -68.41 150.5 75.82 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.072 1.848 . . . . 0.0 113.099 178.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.87 -45.36 40.86 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.516 1.927 . . . . 0.0 111.896 -178.3 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 12.5 tp-100 -57.47 -33.34 67.88 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.934 1.294 . . . . 0.0 113.924 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -86.53 -42.02 13.87 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 119.26 0.936 . . . . 0.0 112.57 174.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 20.7 t -56.26 -45.58 80.02 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 123.655 0.597 . . . . 0.0 111.322 179.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.55 -37.11 85.76 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 176.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -64.38 -48.47 75.34 Favored 'General case' 0 C--N 1.34 0.196 0 C-N-CA 123.31 0.644 . . . . 0.0 110.43 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -65.97 -37.45 86.02 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.625 174.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.5 tt -60.74 -65.03 0.75 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.377 0.989 . . . . 0.0 111.018 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.85 -27.61 69.29 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.42 1.088 . . . . 0.0 112.896 -176.174 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -75.25 -40.27 59.08 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -41.81 95.62 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 174.762 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 7.4 mt -62.08 -40.39 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.466 -0.771 . . . . 0.0 112.104 172.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.89 -28.0 64.22 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -77.84 -26.29 49.31 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.115 0.966 . . . . 0.0 113.55 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -107.71 -52.88 2.7 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.123 1.369 . . . . 0.0 114.176 -172.136 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -82.95 130.99 35.2 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.582 -1.324 . . . . 0.0 110.347 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -59.61 -77.27 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 114.287 -1.324 . . . . 0.0 112.881 -158.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -155.47 -61.27 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 125.021 1.328 . . . . 0.0 110.23 174.111 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -68.52 -37.67 12.51 Favored 'Trans proline' 0 C--N 1.352 0.752 0 CA-C-N 121.501 1.572 . . . . 0.0 110.485 172.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 86' ' ' ASN . . . -52.56 -44.29 65.77 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.145 0.978 . . . . 0.0 111.445 171.521 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -60.5 -51.47 69.31 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.608 1.963 . . . . 0.0 111.309 178.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -60.69 -30.1 71.58 Favored Glycine 0 CA--C 1.526 0.778 0 C-N-CA 125.387 1.47 . . . . 0.0 114.02 177.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -77.29 -33.7 55.72 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.565 1.183 . . . . 0.0 111.09 172.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.99 -46.15 68.79 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.343 -0.848 . . . . 0.0 111.045 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -69.04 -34.13 74.71 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 176.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.45 -53.16 56.46 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.251 0.621 . . . . 0.0 111.901 172.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.4 mt -55.57 -34.35 64.69 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.074 0.949 . . . . 0.0 111.413 175.042 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 36.9 ttp -65.86 -53.41 40.19 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 118.634 0.652 . . . . 0.0 112.12 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -59.72 -44.73 93.6 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.701 -0.624 . . . . 0.0 112.56 176.074 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -62.23 -45.22 94.32 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.45 1.1 . . . . 0.0 111.389 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -58.62 -46.32 87.3 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.886 -0.509 . . . . 0.0 111.3 174.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 68.3 mt -61.76 -46.79 95.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 123.741 0.816 . . . . 0.0 111.32 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -65.62 -34.4 78.14 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.948 1.299 . . . . 0.0 112.252 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -91.75 -3.77 55.8 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 176.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -60.3 -43.49 96.24 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 120.995 -1.066 . . . . 0.0 113.115 -171.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.41 148.81 16.67 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.258 1.823 . . . . 0.0 113.098 178.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -135.69 85.06 2.13 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.071 0.948 . . . . 0.0 111.703 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 38.1 mt . . . . . 0 N--CA 1.48 1.047 0 C-N-CA 127.983 2.513 . . . . 0.0 117.261 176.171 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 . . . . . 0 CA--C 1.541 0.608 0 CA-C-O 120.467 0.175 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.651 ' HG ' HH21 ' A' ' 115' ' ' ARG . 18.3 tp 45.4 57.8 15.36 Favored Pre-proline 0 CA--C 1.557 1.22 0 C-N-CA 128.099 2.56 . . . . 0.0 115.415 170.028 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.37 164.61 22.56 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.741 2.961 . . . . 0.0 115.266 -172.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 73.3 p -90.96 88.36 6.99 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 126.496 1.918 . . . . 0.0 112.017 -174.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.0 m -68.95 34.8 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.383 1.473 . . . . 0.0 114.592 175.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -153.58 152.11 30.53 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.733 -1.229 . . . . 0.0 113.199 -169.104 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -55.58 -11.82 1.01 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 118.181 2.66 . . . . 0.0 118.181 -177.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 99.31 106.78 2.73 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 125.739 1.638 . . . . 0.0 111.664 -171.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.0 t -157.99 171.05 20.96 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 126.057 1.743 . . . . 0.0 110.863 -174.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 89.3 p -150.51 168.32 24.57 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.552 1.541 . . . . 0.0 112.294 -176.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 32.6 m -115.77 156.19 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 125.858 1.663 . . . . 0.0 110.259 176.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -50.93 -47.98 60.9 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -172.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.24 13.32 59.94 Favored Glycine 0 CA--C 1.538 1.472 0 N-CA-C 115.824 1.09 . . . . 0.0 115.824 174.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.0 t -106.82 29.71 6.76 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.433 1.493 . . . . 0.0 113.219 -171.371 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -64.28 158.92 22.05 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.954 1.702 . . . . 0.0 113.915 -175.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.3 p -116.42 165.48 13.17 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -170.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.4 p -140.32 131.84 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 126.702 2.001 . . . . 0.0 111.145 -165.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -81.92 174.21 11.49 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.17 0.988 . . . . 0.0 112.069 172.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.71 -7.95 0.34 Allowed 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 117.136 2.273 . . . . 0.0 117.136 -171.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.4 t -145.84 48.64 1.23 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.716 1.207 . . . . 0.0 111.729 171.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.58 -121.83 5.55 Favored Glycine 0 CA--C 1.528 0.856 0 O-C-N 120.626 -1.296 . . . . 0.0 110.463 -174.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 57.9 -176.69 0.07 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.169 0.988 . . . . 0.0 111.32 -168.224 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -115.03 119.84 37.84 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.055 -1.028 . . . . 0.0 108.432 170.116 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.2 mt -84.2 135.73 34.25 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 119.156 0.889 . . . . 0.0 110.46 174.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 24.4 mt -66.14 102.14 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 124.265 1.026 . . . . 0.0 109.899 -174.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.6 p -142.46 156.67 45.19 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.228 1.811 . . . . 0.0 110.689 -175.422 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 30.0 ttt180 -66.38 -21.66 66.23 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -159.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -51.65 -45.73 63.45 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.54 1.536 . . . . 0.0 113.281 -174.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.0 pt -60.32 -28.31 41.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -177.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.3 ttt85 -65.03 -48.42 73.92 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.056 0.844 . . . . 0.0 110.941 173.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -69.88 -33.88 72.82 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.651 0.38 . . . . 0.0 111.885 -179.22 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.7 mp -56.64 -54.42 46.2 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 118.29 0.496 . . . . 0.0 112.026 171.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -64.46 -39.11 93.2 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.89 -30.82 62.82 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.752 1.16 . . . . 0.0 112.909 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.03 -30.77 71.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 175.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -91.0 -12.43 35.88 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 175.478 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.9 mt -80.32 -38.89 29.74 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 171.204 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.6 m -74.9 134.24 41.64 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 178.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 61.0 23.65 13.8 Favored 'General case' 0 CA--C 1.554 1.115 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 175.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 9.4 p -54.14 -22.08 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.343 0 N-CA-C 116.8 2.148 . . . . 0.0 116.8 -169.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.69 -43.02 1.83 Allowed Glycine 0 CA--C 1.537 1.426 0 C-N-CA 125.81 1.671 . . . . 0.0 116.679 168.204 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -97.26 134.55 40.42 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.093 1.357 . . . . 0.0 110.764 168.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -61.19 -44.7 94.53 Favored Pre-proline 0 CA--C 1.548 0.874 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 173.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -82.81 117.29 2.61 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.489 2.126 . . . . 0.0 110.529 171.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.81 -10.9 1.88 Allowed 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 174.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -47.83 -35.07 9.59 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.648 1.579 . . . . 0.0 113.678 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -86.22 -46.44 10.36 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 63.6 p -69.55 -33.49 72.84 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 118.722 -0.656 . . . . 0.0 111.939 -176.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.1 pp -67.11 -31.54 72.08 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.377 0.671 . . . . 0.0 111.363 172.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -65.92 -42.65 89.85 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.312 0.96 . . . . 0.0 112.562 -172.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.651 HH21 ' HG ' ' A' ' 66' ' ' LEU . 0.7 OUTLIER -76.72 -20.26 56.75 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 119.766 -1.834 . . . . 0.0 111.879 175.099 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.28 -58.0 7.81 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.777 0.431 . . . . 0.0 110.404 171.454 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -63.42 -32.35 73.76 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 121.169 -0.957 . . . . 0.0 112.744 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.45 -43.29 94.72 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.924 0.89 . . . . 0.0 112.436 176.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.52 -42.01 87.93 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.54 -0.725 . . . . 0.0 110.883 174.6 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 18.1 mt -56.77 -42.18 76.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 121.715 -0.615 . . . . 0.0 111.483 172.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -66.9 -19.74 65.78 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.73 -9.03 48.19 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.163 1.385 . . . . 0.0 114.652 171.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -125.42 -37.64 2.35 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -173.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -91.22 143.56 26.53 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.854 1.661 . . . . 0.0 110.236 174.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -64.8 -76.09 0.08 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -155.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -158.12 -58.52 0.02 OUTLIER Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 125.197 1.399 . . . . 0.0 109.812 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.3 -41.09 5.19 Favored 'Trans proline' 0 C--N 1.356 0.925 0 CA-C-N 121.411 1.539 . . . . 0.0 111.241 169.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.06 -41.7 65.08 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 120.765 -1.209 . . . . 0.0 112.536 175.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -60.15 -49.66 76.76 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.566 1.546 . . . . 0.0 110.915 173.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.86 -34.26 70.88 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 125.001 1.286 . . . . 0.0 114.196 175.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.11 -33.38 65.53 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.901 1.35 . . . . 0.0 110.201 175.356 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.73 -43.16 56.44 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.298 -0.876 . . . . 0.0 111.811 -174.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -68.36 -35.74 78.19 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 119.137 -0.458 . . . . 0.0 112.223 174.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.18 -50.21 74.06 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.643 0.656 . . . . 0.0 111.523 172.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.7 mp -56.39 -34.97 67.23 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.268 1.027 . . . . 0.0 112.149 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 3.3 tpt -65.09 -47.01 78.74 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.039 0.836 . . . . 0.0 111.74 177.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -67.06 -42.35 84.91 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.723 -0.611 . . . . 0.0 111.881 176.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -38.93 93.06 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.129 1.372 . . . . 0.0 112.371 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -63.81 -33.75 76.37 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.625 -1.297 . . . . 0.0 112.117 174.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 81.9 mt -77.04 -36.41 24.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.821 1.248 . . . . 0.0 111.589 175.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.599 ' O ' ' OD1' ' A' ' 141' ' ' ASP . 34.0 t0 -68.57 -30.28 69.02 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 120.869 -1.144 . . . . 0.0 110.365 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -96.99 10.03 40.35 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 173.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -68.24 -35.04 77.31 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 120.382 -1.449 . . . . 0.0 113.094 177.371 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -89.63 127.4 35.9 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.214 1.005 . . . . 0.0 111.945 176.066 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -77.95 66.93 3.7 Favored 'General case' 0 CA--C 1.548 0.874 0 O-C-N 121.326 -0.859 . . . . 0.0 111.632 173.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 82.5 mt . . . . . 0 CA--C 1.553 1.079 0 C-N-CA 126.258 1.823 . . . . 0.0 115.544 173.304 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 16.8 m80 . . . . . 0 CA--C 1.543 0.706 0 CA-C-O 120.733 0.302 . . . . 0.0 111.33 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 16.6 mt 51.91 72.58 1.16 Allowed Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 126.763 2.025 . . . . 0.0 113.578 -171.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -74.04 -40.38 1.34 Allowed 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 123.586 2.857 . . . . 0.0 113.998 -178.012 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.6 p -76.58 136.87 39.26 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.297 -0.877 . . . . 0.0 112.693 -170.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.1 p -149.17 164.63 34.19 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.656 0.782 . . . . 0.0 112.804 -178.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.401 ' CE1' ' HB2' ' A' ' 107' ' ' GLU . 14.0 m-85 -92.0 106.83 18.76 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 123.89 0.876 . . . . 0.0 108.996 176.532 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.63 102.11 3.21 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.625 1.17 . . . . 0.0 109.234 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -153.18 -71.36 0.01 OUTLIER Glycine 0 CA--C 1.526 0.733 0 C-N-CA 123.738 0.685 . . . . 0.0 111.548 -177.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.3 t -153.94 153.1 31.41 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.115 0.966 . . . . 0.0 111.554 177.06 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 59.0 m -89.16 135.91 33.31 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.41 1.084 . . . . 0.0 111.867 175.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 15.3 m -144.54 159.69 14.78 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.163 0 C-N-CA 125.493 1.517 . . . . 0.0 111.417 175.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -152.27 133.01 14.01 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.285 2.234 . . . . 0.0 107.329 176.227 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.722 ' HA2' ' OD2' ' A' ' 92' ' ' ASP . . . -88.62 122.23 6.29 Favored Glycine 0 C--O 1.218 -0.891 0 O-C-N 121.142 -0.974 . . . . 0.0 113.004 175.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.8 t -76.98 49.61 0.67 Allowed 'General case' 0 C--N 1.318 -0.782 0 O-C-N 120.13 -1.806 . . . . 0.0 112.378 171.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -62.75 153.45 32.75 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.92 0.888 . . . . 0.0 111.652 173.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.8 p -118.4 159.57 23.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.917 0.865 . . . . 0.0 112.272 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.7 t -118.31 124.8 73.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 C-N-CA 126.446 1.898 . . . . 0.0 107.43 -172.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -79.08 -177.22 5.5 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.116 1.366 . . . . 0.0 110.605 176.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.29 -21.26 5.26 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -174.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.33 52.86 1.27 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.242 1.017 . . . . 0.0 112.333 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.75 -120.24 5.18 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 120.674 -1.266 . . . . 0.0 111.722 -170.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 m120 60.18 171.57 0.09 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.505 1.122 . . . . 0.0 113.42 -173.262 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.35 111.88 23.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.379 -0.826 . . . . 0.0 109.949 172.366 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.5 mt -79.48 153.46 29.59 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 122.964 1.364 . . . . 0.0 112.769 176.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 18.2 mt -57.62 118.69 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.592 1.157 . . . . 0.0 110.338 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.9 p -146.93 130.39 16.75 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.983 0.913 . . . . 0.0 112.068 177.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -69.65 -14.21 62.7 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 120.868 -1.145 . . . . 0.0 113.223 -176.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.722 ' OD2' ' HA2' ' A' ' 77' ' ' GLY . 55.6 t0 -76.33 -15.75 59.9 Favored 'General case' 0 N--CA 1.455 -0.197 0 O-C-N 121.14 -0.975 . . . . 0.0 111.985 -177.036 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.3 -39.51 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.513 0.725 . . . . 0.0 112.4 174.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -64.14 -40.53 96.37 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 120.752 -1.217 . . . . 0.0 112.444 178.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -67.33 -30.4 70.21 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.372 1.069 . . . . 0.0 111.516 178.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -51.93 67.92 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.247 1.019 . . . . 0.0 111.605 172.573 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -67.34 -39.92 85.82 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.743 -0.646 . . . . 0.0 111.241 179.575 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.58 -45.46 93.88 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.13 0.972 . . . . 0.0 112.795 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.34 69.29 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -99.62 -14.84 18.8 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.966 0.906 . . . . 0.0 112.702 174.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.4 mt -70.98 -43.86 67.18 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.454 1.102 . . . . 0.0 112.442 171.284 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.1 t -68.72 -12.61 61.64 Favored 'General case' 0 N--CA 1.485 1.297 0 CA-C-N 120.553 1.524 . . . . 0.0 112.081 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -87.28 25.55 1.37 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.789 1.636 . . . . 0.0 113.871 171.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.8 p -104.84 -17.7 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -178.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -81.2 -51.83 4.53 Favored Glycine 0 N--CA 1.475 1.284 0 O-C-N 121.391 -0.818 . . . . 0.0 113.368 -169.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -82.31 161.08 22.73 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.744 1.218 . . . . 0.0 111.019 168.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 1.285 ' OE1' ' N ' ' A' ' 107' ' ' GLU . 0.0 OUTLIER 61.46 161.16 0.11 Allowed Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 126.672 1.989 . . . . 0.0 113.94 -178.098 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 107' ' ' GLU . 51.3 Cg_endo -63.76 127.44 19.65 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 121.618 1.546 . . . . 0.0 110.483 174.193 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.7 tt -52.52 -34.92 51.96 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.313 1.045 . . . . 0.0 112.371 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -37.97 25.55 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.518 1.127 . . . . 0.0 113.029 173.635 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -74.99 -29.54 60.92 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 44.8 t -62.98 -52.38 63.2 Favored 'General case' 0 N--CA 1.484 1.233 0 O-C-N 121.091 -1.006 . . . . 0.0 109.653 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.41 -32.37 73.71 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-O 117.545 -1.217 . . . . 0.0 113.401 177.722 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.46 -56.83 14.79 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.247 1.419 . . . . 0.0 109.596 178.322 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -67.82 -30.48 69.89 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 173.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.55 -63.92 1.04 Allowed 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.572 1.149 . . . . 0.0 111.751 -174.048 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -23.79 62.02 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 117.819 -1.086 . . . . 0.0 113.605 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.98 -50.33 66.78 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.519 0.728 . . . . 0.0 111.742 170.073 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.93 -47.7 84.1 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.895 0.771 . . . . 0.0 111.459 172.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 60.9 mt -56.32 -44.85 80.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.987 0.812 . . . . 0.0 110.836 179.123 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -76.19 -18.35 59.11 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -86.46 -6.26 58.95 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 173.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.485 ' OE2' ' HA ' ' A' ' 123' ' ' GLU . 27.9 mm-40 -128.49 -37.33 1.81 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -174.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.5 mp -80.69 162.14 24.29 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.137 0.494 . . . . 0.0 110.378 166.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -82.9 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.188 0 CA-C-O 121.921 0.867 . . . . 0.0 113.195 -174.364 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -164.98 -61.41 0.01 OUTLIER Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.443 1.497 . . . . 0.0 109.528 -178.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.1 -42.95 26.58 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.286 1.324 . . . . 0.0 110.906 173.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.5 -40.74 75.48 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.273 1.029 . . . . 0.0 112.724 177.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -60.76 -41.7 96.0 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.235 1.014 . . . . 0.0 110.568 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -56.58 -39.9 86.31 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 124.421 1.01 . . . . 0.0 113.909 174.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -72.03 -38.44 69.56 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.08 0.94 . . . . 0.0 112.972 171.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.62 -50.17 73.66 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 121.352 1.887 . . . . 0.0 112.578 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.1 pp -66.58 -33.57 75.96 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 176.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.39 -50.81 70.04 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.341 -0.849 . . . . 0.0 112.02 171.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 83.2 mt -58.45 -30.78 67.21 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.441 1.019 . . . . 0.0 111.726 176.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 7.6 ttp -63.62 -64.34 0.92 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.225 1.41 . . . . 0.0 111.963 172.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -64.14 -29.32 70.45 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.872 -1.142 . . . . 0.0 112.44 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.84 -46.62 87.07 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.457 1.903 . . . . 0.0 113.269 171.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' TYR . . . . . 0.541 ' C ' ' CD1' ' A' ' 139' ' ' TYR . 0.5 OUTLIER -75.88 -22.28 56.32 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 118.145 -1.422 . . . . 0.0 109.873 -177.367 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 69.1 mt -71.58 -45.13 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.023 171.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -58.55 -45.23 89.37 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.482 1.513 . . . . 0.0 110.395 175.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -93.67 15.65 15.78 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.291 1.037 . . . . 0.0 113.588 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -64.34 -39.67 94.35 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 120.271 -1.518 . . . . 0.0 111.476 -178.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 10.3 mmpt? -74.43 118.77 17.77 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -69.37 70.28 0.26 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.418 1.087 . . . . 0.0 112.392 172.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 31.6 mt . . . . . 0 CA--C 1.55 0.951 0 C-N-CA 124.846 1.258 . . . . 0.0 112.358 171.813 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 65.9 m170 . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 93.0 mt -129.77 48.91 4.08 Favored Pre-proline 0 CA--C 1.552 1.029 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 -173.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -63.96 -24.39 67.34 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 123.456 2.771 . . . . 0.0 114.099 -175.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.1 t -93.61 6.42 48.33 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.797 1.639 . . . . 0.0 113.615 -178.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 75.0 p -66.0 154.5 39.26 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.716 -1.24 . . . . 0.0 114.151 -178.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -70.58 45.41 0.08 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.572 1.949 . . . . 0.0 115.029 -177.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.429 ' H ' ' HG2' ' A' ' 71' ' ' ARG . 10.6 ptt180 -57.21 -28.92 63.29 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 -173.045 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 64.1 -100.27 0.39 Allowed Glycine 0 CA--C 1.532 1.149 0 C-N-CA 123.637 0.637 . . . . 0.0 113.805 171.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 64.6 p -83.17 -161.57 0.52 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.09 2.156 . . . . 0.0 111.514 -178.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.8 p -86.86 94.46 9.57 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 120.228 -1.545 . . . . 0.0 111.404 165.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.9 m -64.3 144.91 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 125.05 1.34 . . . . 0.0 110.449 164.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -93.52 -51.09 5.11 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -163.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 55.98 22.17 33.9 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.951 1.263 . . . . 0.0 116.235 170.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.71 32.35 3.42 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.076 1.438 . . . . 0.0 111.59 -174.47 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -56.27 148.74 17.79 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.299 1.04 . . . . 0.0 112.524 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.6 p -125.32 161.2 27.52 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.716 1.246 . . . . 0.0 113.476 -170.049 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.5 m -138.46 149.11 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 126.103 1.761 . . . . 0.0 109.838 -175.134 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -79.5 177.98 8.46 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 124.354 1.061 . . . . 0.0 111.843 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.19 13.1 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 128.32 2.648 . . . . 0.0 116.767 -177.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.8 m -156.92 30.43 0.31 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.661 1.984 . . . . 0.0 111.355 169.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.1 -127.48 8.69 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 120.557 -1.339 . . . . 0.0 112.219 -173.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 57.09 -170.34 0.1 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.426 1.09 . . . . 0.0 112.282 -167.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.35 116.53 26.39 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.438 -0.789 . . . . 0.0 109.823 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mt -88.64 158.02 18.37 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 123.032 1.396 . . . . 0.0 112.884 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 14.2 mt -80.2 95.11 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 124.462 1.105 . . . . 0.0 110.065 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . 0.256 8.1 t -119.45 3.92 11.22 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.006 1.323 . . . . 0.0 113.731 174.398 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 15.2 ttm105 65.94 -17.75 0.11 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 126.19 1.796 . . . . 0.0 115.42 -177.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -43.01 -47.02 5.71 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.862 1.665 . . . . 0.0 114.814 176.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 48.9 pt -57.18 -27.72 28.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -176.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -70.2 -48.78 55.64 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.158 0.89 . . . . 0.0 110.977 175.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -60.66 -34.4 74.26 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.38 0.672 . . . . 0.0 111.382 173.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 tt -64.09 -49.21 73.16 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.256 1.022 . . . . 0.0 111.864 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -62.8 -44.28 96.58 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.231 0.923 . . . . 0.0 112.711 171.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.11 -42.03 76.18 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.685 1.13 . . . . 0.0 112.308 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.28 -46.25 91.1 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.455 -0.778 . . . . 0.0 112.367 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -78.63 -21.38 48.51 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.7 mt -73.02 -48.33 37.19 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 118.731 0.696 . . . . 0.0 112.145 170.044 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 13.5 t -83.99 -8.16 59.22 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -174.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -127.34 30.99 5.29 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.315 1.446 . . . . 0.0 113.12 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 9.0 p -66.83 -38.21 81.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -171.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 72.14 -2.68 25.96 Favored Glycine 0 CA--C 1.544 1.876 0 N-CA-C 116.632 1.413 . . . . 0.0 116.632 -177.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -146.51 141.02 26.62 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.825 1.65 . . . . 0.0 110.954 -177.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -66.39 -53.39 31.02 Favored Pre-proline 0 N--CA 1.476 0.835 0 C-N-CA 123.643 0.777 . . . . 0.0 112.808 172.032 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.402 ' C ' ' H ' ' A' ' 110' ' ' GLN . 91.7 Cg_endo -72.77 95.17 0.8 Allowed 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 121.878 1.719 . . . . 0.0 108.435 168.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.28 9.98 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 128.748 2.819 . . . . 0.0 115.892 -177.391 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.402 ' H ' ' C ' ' A' ' 108' ' ' PRO . 0.3 OUTLIER -62.1 -47.01 86.55 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 129.087 2.955 . . . . 0.0 113.937 -169.954 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -83.27 -27.3 29.95 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.568 1.077 . . . . 0.0 112.381 -176.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 33.9 t -61.97 -48.83 78.6 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 124.716 1.207 . . . . 0.0 110.154 168.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.49 -38.84 88.13 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 118.149 -0.929 . . . . 0.0 112.15 178.251 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -54.54 -47.12 73.56 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.243 1.417 . . . . 0.0 111.544 179.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.84 -43.01 63.16 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.887 1.275 . . . . 0.0 111.907 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 52.4 tp -57.11 -53.36 58.96 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.459 1.104 . . . . 0.0 111.94 178.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -62.88 -30.13 71.29 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.504 -0.748 . . . . 0.0 112.567 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.94 -40.46 63.06 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.211 1.004 . . . . 0.0 111.617 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.0 -39.39 79.36 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.387 0.675 . . . . 0.0 111.066 175.402 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 17.0 mt -61.62 -43.32 96.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 O-C-N 121.302 -0.874 . . . . 0.0 111.175 172.284 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.65 -25.17 63.79 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -80.91 -36.87 30.57 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 174.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -93.98 -34.35 13.09 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -175.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 27.5 mt -81.28 170.95 15.43 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.448 1.022 . . . . 0.0 112.41 173.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.96 -78.18 0.2 Allowed 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.693 -0.63 . . . . 0.0 112.101 -167.439 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -162.05 -63.37 0.02 OUTLIER Pre-proline 0 CA--C 1.543 0.683 0 C-N-CA 125.581 1.553 . . . . 0.0 109.291 174.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -64.52 -37.19 39.39 Favored 'Trans proline' 0 C--N 1.356 0.922 0 CA-C-N 121.156 1.449 . . . . 0.0 111.126 174.164 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.27 -41.18 62.64 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.403 1.081 . . . . 0.0 112.889 172.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 8.6 ttt180 -63.39 -49.18 74.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.372 1.069 . . . . 0.0 110.587 175.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.71 -31.77 72.3 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.564 1.078 . . . . 0.0 113.894 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -77.22 -32.97 56.25 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.511 1.155 . . . . 0.0 110.95 173.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.22 -46.59 60.85 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.483 -0.761 . . . . 0.0 110.958 -175.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -66.31 -37.96 86.61 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.133 0.573 . . . . 0.0 112.45 174.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.24 -53.58 55.02 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.85 0.75 . . . . 0.0 111.711 176.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 93.0 mt -59.66 -32.51 70.54 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 118.364 -0.827 . . . . 0.0 111.405 177.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 45.9 ttp -66.66 -51.63 53.95 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.558 0.743 . . . . 0.0 112.652 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -65.68 -40.16 92.06 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.302 -0.874 . . . . 0.0 111.763 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -61.63 -44.4 97.06 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.605 1.162 . . . . 0.0 111.475 174.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -60.18 -47.08 87.46 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.646 -0.659 . . . . 0.0 111.317 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 65.1 mt -59.98 -39.68 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.623 0.769 . . . . 0.0 111.198 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -61.66 -43.23 99.26 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -92.09 6.57 46.0 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -79.11 -20.23 49.18 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.262 1.425 . . . . 0.0 112.743 174.12 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.2 ptpp? -82.39 138.84 34.35 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.438 0.695 . . . . 0.0 111.211 169.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -80.32 49.41 1.13 Allowed 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 176.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 39.8 mt . . . . . 0 N--CA 1.478 0.937 0 C-N-CA 126.41 1.884 . . . . 0.0 115.148 179.868 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 CA--C 1.548 0.9 0 CA-C-O 121.958 0.885 . . . . 0.0 112.081 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -59.19 161.88 4.98 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.606 1.963 . . . . 0.0 112.369 172.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.9 p -114.27 165.66 12.45 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.3 1.048 . . . . 0.0 113.648 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.2 p -128.83 130.84 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 126.931 2.093 . . . . 0.0 109.961 -172.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -77.99 173.7 11.9 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.519 1.128 . . . . 0.0 111.477 174.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.01 3.96 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 127.617 2.367 . . . . 0.0 116.403 -173.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 15.2 m -152.55 30.41 0.53 Allowed 'General case' 0 N--CA 1.471 0.591 0 O-C-N 119.896 -1.753 . . . . 0.0 112.517 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 92.09 -128.17 9.26 Favored Glycine 0 CA--C 1.528 0.901 0 O-C-N 120.631 -1.293 . . . . 0.0 110.51 -167.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 57.08 172.74 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.821 1.248 . . . . 0.0 112.989 -169.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.3 122.16 43.19 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 120.977 -1.077 . . . . 0.0 109.321 172.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.7 mt -88.37 143.89 26.73 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 120.223 1.374 . . . . 0.0 111.622 173.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.5 mt -63.4 109.82 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.931 1.292 . . . . 0.0 110.037 -176.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 p -149.37 143.29 25.67 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.302 1.441 . . . . 0.0 110.847 -173.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 32.5 ttt-85 -71.65 -13.57 61.79 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -175.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -51.98 -40.47 60.99 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.699 1.2 . . . . 0.0 112.294 171.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 67.1 mt -54.55 -33.95 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.158 0.983 . . . . 0.0 111.572 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 40.1 ttt85 -83.38 -32.4 26.22 Favored 'General case' 0 N--CA 1.456 -0.144 0 O-C-N 120.941 -1.099 . . . . 0.0 111.686 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -61.98 -35.06 77.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.472 -0.142 . . . . 0.0 111.189 170.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.4 -52.84 56.17 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.144 1.378 . . . . 0.0 111.641 177.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -61.74 -46.0 91.53 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.652 -0.655 . . . . 0.0 112.322 172.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -59.77 -41.42 91.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.305 0.957 . . . . 0.0 112.346 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.92 -43.66 98.39 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.695 -0.628 . . . . 0.0 111.608 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -85.66 -12.88 50.19 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.4 mt -73.22 -40.05 65.01 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.635 1.107 . . . . 0.0 111.97 170.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.9 m . . . . . 0 N--CA 1.472 0.655 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 171.089 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.4 t0 . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 120.843 0.354 . . . . 0.0 111.269 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -70.09 -43.85 70.24 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.207 -0.933 . . . . 0.0 111.929 169.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 54.5 tp -51.13 -61.62 2.12 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.677 0.791 . . . . 0.0 111.44 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.8 ppt_? -60.13 -28.24 67.72 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.847 0.859 . . . . 0.0 112.763 -178.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.76 -41.82 74.67 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 173.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -59.79 -47.84 84.08 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.096 0.862 . . . . 0.0 112.163 176.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.1 mp -60.1 -42.66 90.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 118.517 0.599 . . . . 0.0 111.088 176.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.54 -23.49 65.44 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.42 -50.55 5.89 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.71 0.804 . . . . 0.0 112.735 174.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -76.94 -38.48 53.27 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.416 -1.427 . . . . 0.0 113.206 -170.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.475 HD12 ' HB1' ' A' ' 128' ' ' ALA . 3.3 mm? -68.66 -172.33 0.35 Allowed 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 120.199 1.363 . . . . 0.0 111.567 171.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -97.5 -120.34 0.13 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.632 1.173 . . . . 0.0 110.109 169.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.484 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 20.5 tt0 -120.26 -63.86 0.03 OUTLIER Pre-proline 0 CA--C 1.536 0.423 0 C-N-CA 125.699 1.6 . . . . 0.0 108.448 -172.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.484 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.9 Cg_endo -67.22 -36.3 21.76 Favored 'Trans proline' 0 C--N 1.351 0.675 0 CA-C-N 120.641 1.265 . . . . 0.0 111.307 174.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.475 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -59.74 -34.25 72.71 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 120.833 -1.167 . . . . 0.0 112.477 176.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 19.0 ttt180 -63.09 -48.77 77.17 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.279 1.031 . . . . 0.0 110.434 172.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.14 -34.57 80.21 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 124.729 1.157 . . . . 0.0 113.514 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -75.25 -33.04 61.26 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 118.38 1.09 . . . . 0.0 111.171 174.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.03 -44.93 62.61 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.212 0.605 . . . . 0.0 111.132 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.35 -37.05 80.12 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.252 0.621 . . . . 0.0 112.365 174.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.22 -55.49 24.54 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 118.387 0.54 . . . . 0.0 111.696 175.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.8 mp -56.9 -30.47 63.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.2 175.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 9.3 tmm? -67.34 -52.05 44.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.215 0.916 . . . . 0.0 111.673 176.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -67.37 -38.33 84.6 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.45 -0.781 . . . . 0.0 112.583 177.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.11 -34.96 73.77 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.529 1.532 . . . . 0.0 112.224 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -63.13 -46.94 84.9 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.115 -0.99 . . . . 0.0 110.3 168.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 78.2 mt -60.58 -34.94 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.588 0.755 . . . . 0.0 112.269 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.468 ' O ' ' OD1' ' A' ' 141' ' ' ASP . 48.4 t0 -67.37 -25.3 65.9 Favored 'General case' 0 C--N 1.34 0.177 0 C-N-CA 124.101 0.96 . . . . 0.0 111.63 -177.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -113.21 5.81 17.16 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? . . . . . 0 N--CA 1.479 1.022 0 O-C-N 120.675 -1.265 . . . . 0.0 112.94 -177.957 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 CA--C 1.545 0.781 0 CA-C-O 123.563 1.649 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -68.8 165.75 19.04 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.44 -1.413 . . . . 0.0 111.043 165.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.5 p -134.43 160.33 38.33 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.729 0.776 . . . . 0.0 112.335 175.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.4 t -122.76 128.13 75.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 125.927 1.691 . . . . 0.0 108.193 -169.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -81.84 177.1 9.07 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.561 1.144 . . . . 0.0 112.726 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.93 -19.15 1.63 Allowed 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -170.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.5 m -134.69 29.93 3.48 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.039 1.336 . . . . 0.0 112.434 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 96.21 -123.12 7.59 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -171.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 50.1 m-20 59.22 178.62 0.08 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.66 1.184 . . . . 0.0 114.067 -176.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.12 127.37 54.11 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.369 -0.832 . . . . 0.0 109.114 168.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.8 mt -93.22 149.75 21.0 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 122.117 0.961 . . . . 0.0 110.957 168.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 16.7 mt -79.75 99.74 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 O-C-N 121.447 -0.783 . . . . 0.0 110.625 -173.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 30.1 p -118.28 -1.48 11.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.254 1.022 . . . . 0.0 113.398 170.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 64.95 -0.31 1.05 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.152 1.781 . . . . 0.0 115.389 -175.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -50.06 -49.5 51.05 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.843 1.657 . . . . 0.0 114.718 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.2 pt -52.6 -25.86 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 N-CA-C 113.72 1.008 . . . . 0.0 113.72 -176.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -61.66 -45.59 93.36 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.672 1.124 . . . . 0.0 112.145 171.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -58.29 -40.71 82.67 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.054 0.843 . . . . 0.0 111.637 173.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.47 -39.65 85.29 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.554 0.742 . . . . 0.0 111.983 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -70.88 -43.63 67.99 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.092 0.86 . . . . 0.0 112.603 171.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -59.14 -36.84 75.96 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.4 1.08 . . . . 0.0 112.234 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.89 -24.17 67.45 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 175.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -111.04 -11.78 14.26 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.429 1.092 . . . . 0.0 113.641 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.4 mt -75.93 -33.82 59.87 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.302 1.041 . . . . 0.0 111.008 167.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.4 p . . . . . 0 CA--C 1.538 0.486 0 C-N-CA 124.553 1.141 . . . . 0.0 112.13 170.836 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.477 0.887 0 CA-C-O 121.4 0.619 . . . . 0.0 110.939 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 85.2 mtm180 -65.37 -46.62 79.42 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.475 1.11 . . . . 0.0 111.007 176.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.1 tt -51.05 -64.01 0.95 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.626 1.17 . . . . 0.0 111.4 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -32.48 68.54 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.561 1.144 . . . . 0.0 112.809 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.87 87.38 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.904 -0.569 . . . . 0.0 112.127 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -60.79 -47.85 84.45 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.781 0.719 . . . . 0.0 112.116 176.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.3 mp -63.15 -45.03 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.155 0.889 . . . . 0.0 111.348 176.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.79 -29.74 69.01 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -179.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.67 -65.83 0.74 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.812 0.845 . . . . 0.0 110.899 172.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -70.72 -46.08 63.73 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.304 1.441 . . . . 0.0 113.403 -169.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 6.8 mp -78.58 164.13 24.93 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 120.727 -1.233 . . . . 0.0 109.809 168.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -79.09 -93.47 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.499 0.72 . . . . 0.0 112.329 -165.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.465 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 47.0 tt0 -146.92 -54.6 0.02 OUTLIER Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 124.962 1.305 . . . . 0.0 111.198 175.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.465 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 64.2 Cg_endo -70.84 -38.89 4.91 Favored 'Trans proline' 0 C--N 1.354 0.84 0 CA-C-N 121.449 1.553 . . . . 0.0 111.004 171.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.69 -42.08 64.46 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.221 1.408 . . . . 0.0 112.678 177.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -56.36 -49.29 74.82 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.766 2.026 . . . . 0.0 111.19 173.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.22 -34.38 67.13 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 125.151 1.357 . . . . 0.0 113.798 176.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -76.79 -31.19 56.83 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.457 1.128 . . . . 0.0 110.92 175.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.2 -50.98 50.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 122.87 0.468 . . . . 0.0 110.36 -178.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.7 pp -66.34 -35.77 81.21 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 177.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.65 -53.11 56.51 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.603 0.638 . . . . 0.0 112.019 174.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.67 -27.57 68.78 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 117.655 -1.164 . . . . 0.0 111.692 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -64.93 -53.09 51.86 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.866 1.212 . . . . 0.0 111.677 173.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -64.31 -41.45 96.84 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 177.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -68.41 -40.39 81.28 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.011 1.324 . . . . 0.0 112.671 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -58.19 -38.51 76.87 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.201 -0.937 . . . . 0.0 111.157 169.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 86.4 mt -71.23 -44.43 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 123.712 0.805 . . . . 0.0 112.387 177.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -54.44 -31.43 55.39 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.608 1.563 . . . . 0.0 111.466 174.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -106.34 3.93 28.06 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 178.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt . . . . . 0 N--CA 1.485 1.279 0 C-N-CA 125.022 1.329 . . . . 0.0 112.875 179.018 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 C--O 1.238 0.487 0 CA-C-O 121.151 0.501 . . . . 0.0 109.701 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -53.48 154.96 3.18 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.435 1.112 . . . . 0.0 111.711 175.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 5.9 p -114.2 157.88 22.09 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.204 1.402 . . . . 0.0 111.722 -175.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.5 t -129.48 128.23 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 125.505 1.522 . . . . 0.0 107.478 -172.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -81.54 -175.17 5.38 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.736 0.814 . . . . 0.0 111.293 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.39 -21.0 8.44 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -172.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -144.73 50.79 1.26 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.291 1.036 . . . . 0.0 112.334 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.07 -122.82 5.84 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 120.376 -1.452 . . . . 0.0 110.826 -169.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 60.31 172.0 0.09 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.338 1.055 . . . . 0.0 112.964 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.59 119.14 38.65 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 170.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.62 143.52 38.17 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-O 121.568 0.699 . . . . 0.0 110.12 173.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 48.0 mm -73.23 108.33 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 O-C-N 121.56 -0.712 . . . . 0.0 109.932 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.2 p -152.32 158.24 42.47 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.991 1.316 . . . . 0.0 112.392 177.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -57.93 -14.23 5.9 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.488 1.515 . . . . 0.0 114.494 -174.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -66.15 -28.79 69.06 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 122.47 0.308 . . . . 0.0 111.7 -178.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.542 HG21 HD23 ' A' ' 135' ' ' LEU . 88.1 mt -62.51 -53.99 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 121.285 0.564 . . . . 0.0 111.662 178.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -72.28 -28.75 63.31 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 118.587 -0.72 . . . . 0.0 112.818 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.48 -40.11 73.81 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.75 174.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.07 -51.25 58.78 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.819 1.247 . . . . 0.0 111.606 170.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -66.0 -36.12 82.42 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.034 -1.041 . . . . 0.0 112.056 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.57 -48.13 80.81 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.982 1.264 . . . . 0.0 111.306 173.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.44 -35.32 75.54 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.99 0.916 . . . . 0.0 112.644 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -91.04 -17.09 26.83 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.9 mt -72.98 -34.95 66.77 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 120.605 -1.31 . . . . 0.0 113.019 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 CA--C 1.545 0.781 0 CA-C-N 119.339 0.972 . . . . 0.0 113.096 175.045 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.2 t70 . . . . . 0 N--CA 1.472 0.649 0 N-CA-C 110.524 -0.176 . . . . 0.0 110.524 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.0 mtt180 -78.03 -41.29 36.17 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.767 0.827 . . . . 0.0 111.167 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 33.2 tp -55.99 -59.77 4.43 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.966 0.412 . . . . 0.0 111.994 177.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -24.83 64.44 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.349 -0.834 . . . . 0.0 113.002 -178.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.48 -51.27 53.34 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.864 0.756 . . . . 0.0 111.842 170.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -51.06 69.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.551 0.74 . . . . 0.0 110.812 173.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 62.1 mt -55.45 -43.7 73.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 O-C-N 121.7 -0.625 . . . . 0.0 111.461 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -77.8 -24.66 48.75 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -75.73 -42.54 50.41 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.606 0.763 . . . . 0.0 110.056 172.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -76.74 -61.13 2.07 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 124.598 1.159 . . . . 0.0 112.9 -178.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 57.5 mt -60.38 171.9 0.97 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.926 1.239 . . . . 0.0 112.221 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 10.8 tp-100 -71.48 -88.99 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.857 0.863 . . . . 0.0 111.936 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -166.13 -59.19 0.01 OUTLIER Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 125.645 1.578 . . . . 0.0 109.432 -172.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -63.2 -44.49 15.04 Favored 'Trans proline' 0 C--N 1.359 1.104 0 CA-C-N 120.357 1.163 . . . . 0.0 110.748 171.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.27 -37.54 75.17 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.435 1.094 . . . . 0.0 112.772 177.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 14.1 ttt180 -58.24 -47.24 84.15 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.484 0.714 . . . . 0.0 110.671 174.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -54.08 -45.47 72.45 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.299 0.952 . . . . 0.0 112.793 176.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.08 -37.19 83.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.01 0.905 . . . . 0.0 113.16 174.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.42 -50.01 61.26 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 120.627 1.558 . . . . 0.0 112.324 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.0 pp -65.45 -34.82 79.19 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.732 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.35 -48.38 75.75 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-O 119.054 -0.498 . . . . 0.0 111.301 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.542 HD23 HG21 ' A' ' 93' ' ' ILE . 6.0 mp -61.01 -28.07 68.77 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.349 -1.31 . . . . 0.0 111.471 175.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.39 -58.47 6.97 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 120.154 1.343 . . . . 0.0 111.851 172.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -66.75 -37.14 84.05 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.276 -0.89 . . . . 0.0 112.48 178.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.21 -45.02 90.1 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.154 1.382 . . . . 0.0 112.102 174.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -59.3 -42.26 90.93 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 118.876 -0.583 . . . . 0.0 110.609 171.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.99 -33.61 59.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-O 118.091 -0.957 . . . . 0.0 112.17 175.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -62.87 -44.04 97.18 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.398 0.999 . . . . 0.0 112.466 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -100.21 14.2 31.65 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 174.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 23.2 ttpt . . . . . 0 N--CA 1.483 1.189 0 O-C-N 120.639 -1.288 . . . . 0.0 112.865 -175.922 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 CA--C 1.546 0.82 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -62.07 154.31 27.29 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.824 1.25 . . . . 0.0 114.262 -168.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.563 ' H ' HG21 ' A' ' 90' ' ' THR . 35.8 p -92.24 152.92 19.59 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.067 1.347 . . . . 0.0 112.956 177.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.3 t -122.89 137.27 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 126.052 1.741 . . . . 0.0 107.926 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.407 ' HB3' HD22 ' A' ' 86' ' ' ASN . 15.5 t0 -75.8 175.64 8.53 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.428 1.091 . . . . 0.0 111.794 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.7 -12.38 1.83 Allowed 'General case' 0 CA--C 1.553 1.09 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 -174.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.8 m -155.63 64.53 0.6 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.773 1.629 . . . . 0.0 110.536 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 73.6 -123.96 8.48 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 121.709 -0.619 . . . . 0.0 111.97 -174.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.407 HD22 ' HB3' ' A' ' 82' ' ' ASP . 6.7 m-80 55.31 -179.51 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.864 1.265 . . . . 0.0 112.733 -172.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -115.3 127.23 55.31 Favored 'General case' 0 N--CA 1.481 1.116 0 O-C-N 120.291 -1.506 . . . . 0.0 110.747 171.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.8 mt -96.23 154.66 17.13 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 122.709 1.243 . . . . 0.0 112.863 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 32.6 mm -78.48 93.57 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 124.555 1.142 . . . . 0.0 111.235 -175.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.563 HG21 ' H ' ' A' ' 80' ' ' SER 0.255 13.7 t -132.15 12.96 4.69 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -179.29 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 66.82 -19.27 0.11 Allowed 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 116.671 2.1 . . . . 0.0 116.671 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -42.62 -51.22 5.27 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 126.385 1.874 . . . . 0.0 114.828 178.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 21.6 pt -55.51 -31.29 27.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 94' ' ' ARG . 2.7 mtp85 -67.02 -43.77 81.98 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.164 -0.96 . . . . 0.0 111.527 175.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -69.51 -19.67 63.72 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.699 1.6 . . . . 0.0 112.919 176.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.86 -56.94 4.15 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.087 1.355 . . . . 0.0 111.246 167.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -59.82 -41.5 91.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.095 0.861 . . . . 0.0 112.89 -178.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -64.96 -37.68 88.46 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.875 0.761 . . . . 0.0 111.953 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.08 -30.44 70.35 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.415 0.895 . . . . 0.0 113.415 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -89.12 -38.23 14.48 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.793 0.837 . . . . 0.0 113.043 173.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.2 mt -59.02 -45.25 91.16 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.342 0.974 . . . . 0.0 111.041 176.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.3 m . . . . . 0 CA--C 1.546 0.812 0 C-N-CA 125.105 1.362 . . . . 0.0 114.307 177.697 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.468 0.45 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 70.1 mtt-85 -70.03 -44.94 68.22 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.665 -0.647 . . . . 0.0 111.81 171.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.2 tt -50.08 -61.55 2.09 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.231 1.013 . . . . 0.0 111.533 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.97 -27.51 68.33 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.514 -1.366 . . . . 0.0 113.387 179.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.69 -43.5 68.9 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 124.127 0.892 . . . . 0.0 111.566 177.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -53.98 -52.39 60.87 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.641 0.776 . . . . 0.0 111.545 176.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.18 -42.71 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 O-C-N 121.371 -0.831 . . . . 0.0 111.922 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.41 ' HB2' ' CZ ' ' A' ' 129' ' ' ARG . . . -70.28 -31.03 68.21 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.029 -1.045 . . . . 0.0 113.596 -178.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.08 -63.97 0.95 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.417 0.687 . . . . 0.0 110.483 169.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -62.06 -50.44 71.96 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.19 2.196 . . . . 0.0 113.929 -171.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.441 HD12 ' HB1' ' A' ' 128' ' ' ALA . 2.6 mm? -78.59 164.47 24.64 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 122.276 1.036 . . . . 0.0 110.328 176.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -77.2 -94.13 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.183 0.993 . . . . 0.0 111.447 -169.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.519 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 37.6 tt0 -140.79 -58.68 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 124.646 1.178 . . . . 0.0 110.454 167.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.519 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.2 Cg_endo -66.88 -35.75 25.68 Favored 'Trans proline' 0 C--N 1.352 0.739 0 CA-C-N 122.036 1.763 . . . . 0.0 111.484 176.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.441 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -57.98 -32.01 67.46 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 120.98 -1.075 . . . . 0.0 112.779 173.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.41 ' CZ ' ' HB2' ' A' ' 121' ' ' ALA . 0.0 OUTLIER -64.14 -48.77 74.73 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.063 1.345 . . . . 0.0 109.903 173.499 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.19 -34.32 87.63 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 126.415 1.959 . . . . 0.0 114.49 176.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -74.98 -30.71 61.26 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.777 1.288 . . . . 0.0 110.475 173.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.86 58.42 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 122.909 0.484 . . . . 0.0 110.357 -176.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -66.51 -39.76 88.85 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 118.914 -0.565 . . . . 0.0 111.841 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.42 -54.54 44.3 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.37 0.986 . . . . 0.0 111.913 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 9.2 mp -64.45 -25.96 68.23 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.698 176.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 59.7 ttp -65.78 -53.02 45.96 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 120.056 1.298 . . . . 0.0 111.831 172.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . 0.506 ' HA ' HE21 ' A' ' 137' ' ' GLN . 0.0 OUTLIER -66.92 -43.15 84.03 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.122 0.874 . . . . 0.0 111.619 178.344 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -28.16 68.29 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.412 1.085 . . . . 0.0 112.846 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -68.0 -47.74 67.68 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.468 -1.395 . . . . 0.0 111.186 167.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 85.8 mt -62.27 -38.58 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.387 1.075 . . . . 0.0 112.561 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -52.98 -32.92 48.85 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.215 1.806 . . . . 0.0 113.09 173.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -112.85 2.69 16.02 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.405 1.482 . . . . 0.0 114.02 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? . . . . . 0 N--CA 1.48 1.045 0 C-N-CA 125.932 1.693 . . . . 0.0 112.681 175.814 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.467 0.404 0 CA-C-O 120.972 0.415 . . . . 0.0 110.0 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -78.1 178.98 7.12 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 128.041 2.536 . . . . 0.0 113.157 -174.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 32.5 p -115.35 161.67 18.19 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.771 1.229 . . . . 0.0 113.921 176.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.1 t -135.7 133.42 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 126.174 1.79 . . . . 0.0 109.541 -171.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -88.98 178.25 6.45 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.722 1.209 . . . . 0.0 112.961 177.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.53 -1.64 0.16 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 127.928 2.491 . . . . 0.0 117.718 -167.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 31.0 t -152.56 35.94 0.51 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.398 1.479 . . . . 0.0 111.372 173.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 87.47 -123.15 6.48 Favored Glycine 0 CA--C 1.529 0.912 0 O-C-N 120.934 -1.104 . . . . 0.0 110.649 -167.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 59.39 175.92 0.08 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.951 0.9 . . . . 0.0 111.665 -163.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.9 132.48 52.8 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 117.788 -1.101 . . . . 0.0 108.901 165.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.3 mt -98.69 150.51 21.72 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.916 1.235 . . . . 0.0 112.316 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 24.5 mt -63.62 111.81 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 125.144 1.378 . . . . 0.0 110.628 -173.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -142.74 154.38 44.22 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.76 1.224 . . . . 0.0 112.291 -173.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -101.03 -10.54 20.43 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -164.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -64.69 -29.48 70.47 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.892 0.877 . . . . 0.0 111.66 168.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 64.5 mt -49.77 -40.38 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 125.778 1.631 . . . . 0.0 112.103 175.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.18 -53.19 58.84 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 121.417 -0.802 . . . . 0.0 110.978 173.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -61.45 -30.0 70.31 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.823 0.849 . . . . 0.0 111.997 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.88 -53.52 52.84 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.984 1.714 . . . . 0.0 111.746 173.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -60.94 -43.55 98.51 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.32 -0.848 . . . . 0.0 112.416 173.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.47 -40.65 87.64 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.179 1.354 . . . . 0.0 112.636 177.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.88 -20.78 66.61 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -112.39 -21.74 11.22 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.365 1.066 . . . . 0.0 113.656 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.12 -48.94 74.12 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 118.998 0.817 . . . . 0.0 110.079 169.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 CA--C 1.54 0.563 0 C-N-CA 123.809 0.843 . . . . 0.0 113.137 179.231 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 55.4 t0 . . . . . 0 N--CA 1.474 0.775 0 CA-C-O 120.789 0.328 . . . . 0.0 110.809 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.4 mtt85 -59.97 -40.61 89.69 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.071 -1.018 . . . . 0.0 112.263 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 50.5 tp -62.12 -57.35 11.88 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.795 0.838 . . . . 0.0 112.496 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.6 ptm85 -60.91 -33.8 73.7 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.677 -0.639 . . . . 0.0 111.589 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.66 -44.02 87.58 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 124.198 0.936 . . . . 0.0 111.421 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.74 -42.7 81.42 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.477 0.711 . . . . 0.0 110.741 176.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 18.0 mt -61.09 -42.44 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.259 -0.901 . . . . 0.0 111.208 176.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.38 -22.2 61.91 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -84.64 -31.62 24.1 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 171.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -99.73 -34.77 10.04 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 115.324 1.601 . . . . 0.0 115.324 -173.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 60.2 mt -81.72 174.32 11.47 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.394 0.997 . . . . 0.0 111.611 167.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.34 -97.56 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.93 0.892 . . . . 0.0 111.525 -176.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.445 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 49.3 tt0 -145.43 -57.54 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.629 0 O-C-N 120.964 -1.085 . . . . 0.0 110.293 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.445 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.7 Cg_endo -69.76 -37.94 8.49 Favored 'Trans proline' 0 C--N 1.355 0.897 0 CA-C-N 121.581 1.6 . . . . 0.0 112.133 173.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.73 -39.85 68.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.699 1.2 . . . . 0.0 112.157 176.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -58.17 -46.81 85.09 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.128 1.371 . . . . 0.0 110.74 174.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -56.3 -34.37 62.97 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 125.363 1.459 . . . . 0.0 113.621 175.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -77.61 -30.6 52.46 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 118.622 1.211 . . . . 0.0 111.494 175.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.36 -45.4 60.03 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.541 -0.725 . . . . 0.0 111.291 -178.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.79 -34.11 75.0 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.611 -0.709 . . . . 0.0 112.371 173.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.87 -53.58 56.18 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 119.144 0.884 . . . . 0.0 111.614 173.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 72.6 mt -55.41 -37.16 67.26 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.05 0.54 . . . . 0.0 111.328 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -52.51 46.56 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.051 0.94 . . . . 0.0 111.933 177.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -64.68 -38.94 92.71 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.735 -1.228 . . . . 0.0 112.834 178.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -43.76 98.19 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.837 1.255 . . . . 0.0 111.165 172.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -60.51 -39.87 89.32 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.533 -0.73 . . . . 0.0 111.566 172.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 59.7 mt -67.13 -35.21 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 119.934 1.243 . . . . 0.0 112.359 177.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -58.02 -49.78 75.68 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.492 0.717 . . . . 0.0 110.32 170.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -93.08 -0.53 57.05 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -173.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt . . . . . 0 N--CA 1.482 1.134 0 C-N-CA 124.437 1.095 . . . . 0.0 112.646 -178.73 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.7 t . . . . . 0 N--CA 1.475 0.782 0 CA-C-O 121.52 0.676 . . . . 0.0 109.951 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -63.24 163.92 9.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.504 1.122 . . . . 0.0 111.689 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.6 p -112.35 149.64 32.18 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.368 1.067 . . . . 0.0 113.072 -173.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.1 t -122.5 129.87 74.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.988 1.715 . . . . 0.0 109.67 -173.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.48 ' HB3' HD22 ' A' ' 86' ' ' ASN . 3.0 t0 -80.74 179.81 7.62 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.997 1.719 . . . . 0.0 112.537 178.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.29 -3.41 0.62 Allowed 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 116.603 2.075 . . . . 0.0 116.603 -172.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.7 m -162.6 64.59 0.21 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.671 1.988 . . . . 0.0 109.864 168.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.72 -123.91 6.4 Favored Glycine 0 CA--C 1.53 1.022 0 O-C-N 121.478 -0.764 . . . . 0.0 111.601 -177.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.48 HD22 ' HB3' ' A' ' 82' ' ' ASP . 7.1 m-80 57.25 179.42 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.848 1.259 . . . . 0.0 112.972 -171.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.79 118.6 36.59 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.242 -0.911 . . . . 0.0 109.376 169.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.8 mt -84.77 160.87 20.18 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 122.145 0.974 . . . . 0.0 111.611 171.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 15.9 mt -80.33 91.64 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 124.448 1.099 . . . . 0.0 110.4 -173.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 53.4 p -133.24 153.79 51.24 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.699 1.199 . . . . 0.0 110.708 164.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 8.9 tpp85 -70.49 -7.92 47.26 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -162.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -55.36 -44.93 76.45 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 127.108 2.163 . . . . 0.0 115.061 -167.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 39.5 pt -60.4 -28.47 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 123.826 0.851 . . . . 0.0 112.828 -173.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 62.5 ttt-85 -68.55 -35.89 78.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 122.672 0.389 . . . . 0.0 110.95 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -79.24 -34.24 42.88 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.283 0.633 . . . . 0.0 111.804 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.8 mp -56.96 -51.59 68.61 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.889 -0.577 . . . . 0.0 111.509 165.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -61.26 -42.96 99.53 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.956 0.798 . . . . 0.0 111.697 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.02 -41.88 97.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.33 0.968 . . . . 0.0 112.668 -179.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.92 -44.9 96.56 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.276 -0.89 . . . . 0.0 111.824 178.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -83.68 -8.96 59.17 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.2 mt -78.91 -33.19 45.76 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.812 1.187 . . . . 0.0 112.473 169.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 12.5 t . . . . . 0 N--CA 1.474 0.771 0 CA-C-N 119.259 0.936 . . . . 0.0 112.274 171.076 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 13.9 t0 . . . . . 0 N--CA 1.479 0.994 0 CA-C-O 120.98 0.419 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -69.3 -41.8 76.27 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 120.924 -1.11 . . . . 0.0 112.466 170.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 46.2 tp -51.47 -63.38 1.15 Allowed 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.044 0.537 . . . . 0.0 111.701 175.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -30.66 68.1 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.273 1.029 . . . . 0.0 112.75 177.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.54 -39.9 94.62 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 174.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -62.65 -51.38 67.5 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.062 0.846 . . . . 0.0 111.9 174.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.415 HD12 ' H ' ' A' ' 120' ' ' ILE . 4.4 mp -58.75 -41.53 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.319 0.963 . . . . 0.0 111.118 177.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.1 -18.13 63.94 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -101.32 -33.2 10.13 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -78.52 -45.46 21.87 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.382 1.073 . . . . 0.0 112.45 177.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.431 HD12 ' HB1' ' A' ' 128' ' ' ALA . 2.6 mm? -84.89 174.88 9.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.12 0.968 . . . . 0.0 111.574 176.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.85 -99.99 0.1 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.282 0.633 . . . . 0.0 112.288 -177.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.438 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 17.6 tt0 -135.22 -63.9 0.02 OUTLIER Pre-proline 0 N--CA 1.472 0.657 0 O-C-N 120.807 -1.183 . . . . 0.0 109.138 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.438 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 87.5 Cg_endo -68.58 -34.03 20.66 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 CA-C-N 121.127 1.438 . . . . 0.0 111.702 173.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.431 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -60.75 -36.39 78.8 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 120.77 -1.206 . . . . 0.0 112.078 174.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -63.91 -49.51 72.37 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.509 1.124 . . . . 0.0 110.413 172.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.32 -34.13 73.29 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.871 1.224 . . . . 0.0 113.879 178.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -75.08 -33.67 61.69 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.466 1.133 . . . . 0.0 110.682 175.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.47 -46.13 64.36 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.698 -0.626 . . . . 0.0 110.926 -176.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.29 -36.63 79.65 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 118.804 -0.617 . . . . 0.0 112.176 174.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.7 -54.08 49.63 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.301 0.955 . . . . 0.0 111.976 175.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 97.0 mt -58.7 -34.73 71.64 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.395 176.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 49.5 ttp -65.38 -52.02 56.45 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.4 0.68 . . . . 0.0 112.26 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -64.33 -42.9 96.06 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.768 -0.582 . . . . 0.0 111.604 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -44.9 95.99 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.604 1.162 . . . . 0.0 111.715 176.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -59.9 -44.48 94.22 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.155 0.434 . . . . 0.0 111.467 174.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 74.6 mt -62.24 -35.32 68.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 118.686 0.675 . . . . 0.0 111.414 176.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -63.02 -32.19 73.5 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.029 0.932 . . . . 0.0 113.111 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 3.5 p90 -108.81 -0.14 20.05 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 116.242 1.941 . . . . 0.0 116.242 174.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt . . . . . 0 N--CA 1.48 1.072 0 C-N-CA 125.752 1.621 . . . . 0.0 112.634 178.018 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.8 t . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 120.918 0.39 . . . . 0.0 111.397 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -65.78 152.79 43.54 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.801 0.81 . . . . 0.0 111.602 177.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 98.5 p -133.56 157.8 44.77 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.867 0.841 . . . . 0.0 113.002 -173.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.6 t -127.71 130.93 70.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.338 1.455 . . . . 0.0 110.088 -166.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -79.12 173.32 12.7 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.346 1.858 . . . . 0.0 113.632 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.54 -10.12 2.03 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 -177.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 19.8 m -138.29 29.88 2.44 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.793 1.637 . . . . 0.0 111.848 175.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 93.13 -109.08 3.74 Favored Glycine 0 C--N 1.339 0.746 0 O-C-N 120.445 -1.409 . . . . 0.0 110.766 -173.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 128' ' ' ALA . 71.4 m-20 52.05 -172.16 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.679 1.191 . . . . 0.0 113.758 -174.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -113.48 126.03 54.87 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 164.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.5 mt -91.61 140.96 29.23 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.338 0.972 . . . . 0.0 110.27 170.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 31.6 mm -80.68 105.46 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.917 0.865 . . . . 0.0 110.851 -178.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.1 p -132.56 22.63 4.33 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 125.255 1.422 . . . . 0.0 113.247 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 64.24 -4.39 0.41 Allowed 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 126.811 2.045 . . . . 0.0 115.88 177.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -54.78 -53.83 50.08 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 129.23 3.012 . . . . 0.0 114.834 178.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 30.2 pt -54.77 -33.3 27.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.928 0.891 . . . . 0.0 113.177 -177.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -65.01 -38.58 91.41 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.984 1.265 . . . . 0.0 112.217 177.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -67.97 -35.11 77.81 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.238 0.615 . . . . 0.0 111.553 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.18 -44.02 80.72 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.807 0.843 . . . . 0.0 111.35 174.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -63.6 -43.6 96.44 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.099 0.863 . . . . 0.0 112.693 171.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -58.09 -46.43 85.51 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.599 1.09 . . . . 0.0 112.75 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.62 -30.97 67.66 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -102.19 -12.17 18.23 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 24.7 mt -74.86 -41.1 60.46 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.617 1.098 . . . . 0.0 111.376 167.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 5.7 t . . . . . 0 CA--C 1.541 0.619 0 CA-C-N 118.322 0.51 . . . . 0.0 110.852 175.875 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 58.6 t0 . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 111.417 0.154 . . . . 0.0 111.417 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -66.23 -35.47 80.51 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 118.451 -0.785 . . . . 0.0 111.821 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.466 ' O ' HD12 ' A' ' 120' ' ' ILE . 55.3 tp -57.94 -61.81 2.27 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.623 0.769 . . . . 0.0 111.025 176.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -60.58 -27.79 67.97 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.278 -0.889 . . . . 0.0 112.726 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.07 -37.53 66.76 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.86 0.864 . . . . 0.0 113.044 173.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -63.68 -53.38 52.22 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.096 -0.954 . . . . 0.0 111.499 174.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.466 HD12 ' O ' ' A' ' 116' ' ' LEU . 3.7 mp -55.79 -36.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 120.633 1.56 . . . . 0.0 111.537 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.451 ' HA ' ' HD2' ' A' ' 129' ' ' ARG . . . -70.68 -24.78 62.74 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.537 1.68 . . . . 0.0 115.537 178.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -99.22 -29.31 12.9 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.997 1.319 . . . . 0.0 113.785 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -82.26 -46.14 14.08 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.484 1.514 . . . . 0.0 113.694 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 7.5 mp -89.21 176.3 7.01 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.02 0.928 . . . . 0.0 110.495 171.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.38 -96.94 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.941 0.896 . . . . 0.0 111.767 -175.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.47 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 34.7 tt0 -155.03 -52.65 0.02 OUTLIER Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 124.96 1.304 . . . . 0.0 110.909 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.47 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 56.7 Cg_endo -64.78 -43.9 11.59 Favored 'Trans proline' 0 C--N 1.353 0.804 0 CA-C-N 121.673 1.633 . . . . 0.0 109.948 167.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 86' ' ' ASN . . . -49.97 -38.83 38.68 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.851 1.261 . . . . 0.0 113.007 172.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.463 HH11 ' HD3' ' A' ' 129' ' ' ARG . 26.5 ttt180 -72.19 -42.53 65.73 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 121.602 -0.686 . . . . 0.0 110.869 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.8 -32.62 75.08 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-O 119.524 -0.598 . . . . 0.0 113.976 175.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -79.28 -30.35 42.93 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.34 1.07 . . . . 0.0 111.29 175.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.36 -46.91 63.16 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.646 -0.659 . . . . 0.0 111.109 -178.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.7 pp -66.79 -36.63 82.85 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.308 0.643 . . . . 0.0 112.393 175.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.99 -52.0 64.67 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.659 -0.65 . . . . 0.0 112.426 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.86 -28.82 69.76 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.489 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 9.4 tmm? -67.36 -53.47 29.19 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.044 0.838 . . . . 0.0 112.105 175.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.59 -42.32 98.69 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.07 -1.019 . . . . 0.0 113.363 172.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.37 -42.29 96.25 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.167 0.987 . . . . 0.0 111.959 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 32.7 t80 -59.56 -43.83 93.46 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.751 -0.593 . . . . 0.0 111.242 171.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.11 -41.74 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-O 118.667 -0.683 . . . . 0.0 112.132 -178.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -61.16 -49.91 75.31 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.091 0.956 . . . . 0.0 111.523 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.9 m-30 -89.01 6.62 38.84 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -175.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt . . . . . 0 N--CA 1.479 1.005 0 C-N-CA 125.194 1.397 . . . . 0.0 112.188 174.013 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.4 t . . . . . 0 N--CA 1.475 0.804 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.803 ' HA ' ' OD1' ' A' ' 92' ' ' ASP . 6.6 p90 -147.54 172.96 13.17 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -164.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 94.0 p -88.29 168.03 13.05 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.821 2.049 . . . . 0.0 114.883 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 p -154.22 136.89 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 125.541 1.537 . . . . 0.0 111.484 -177.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -84.35 170.95 13.1 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.632 1.173 . . . . 0.0 111.579 173.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.96 3.76 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 117.688 2.477 . . . . 0.0 117.688 -170.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 39.5 m -159.22 52.09 0.38 Allowed 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.008 1.723 . . . . 0.0 110.109 168.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.89 -124.35 6.43 Favored Glycine 0 CA--C 1.528 0.899 0 O-C-N 120.2 -1.562 . . . . 0.0 111.228 -174.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 59.79 177.8 0.09 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.333 1.053 . . . . 0.0 111.615 -169.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.1 mt -112.14 128.23 56.16 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.824 -1.172 . . . . 0.0 109.536 170.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mt -95.52 161.83 13.9 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.992 0.901 . . . . 0.0 111.807 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.4 mm -83.87 89.64 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 124.599 1.16 . . . . 0.0 111.494 -173.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 69.3 p -141.62 166.43 24.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.709 175.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.418 ' CG ' ' HD3' ' A' ' 94' ' ' ARG . 43.7 ttm-85 -93.02 45.41 1.18 Allowed 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 115.005 -0.998 . . . . 0.0 113.398 -164.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.803 ' OD1' ' HA ' ' A' ' 79' ' ' PHE . 0.2 OUTLIER -102.71 -60.16 1.59 Allowed 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.614 -0.679 . . . . 0.0 112.691 -178.358 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 20.8 pt -47.41 -24.04 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -176.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.418 ' HD3' ' CG ' ' A' ' 91' ' ' ARG . 9.5 ptm85 -74.06 -31.03 62.69 Favored 'General case' 0 N--CA 1.456 -0.127 0 O-C-N 120.896 -1.127 . . . . 0.0 111.249 -177.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -74.4 -32.03 62.55 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.317 1.047 . . . . 0.0 111.032 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.3 tt -63.44 -52.75 60.14 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.577 1.551 . . . . 0.0 110.661 176.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -56.58 -46.01 81.02 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.295 -0.878 . . . . 0.0 112.731 169.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.57 -38.87 85.98 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 119.661 1.119 . . . . 0.0 112.55 -179.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.82 -37.17 83.45 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.189 0.996 . . . . 0.0 112.982 178.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -99.85 -3.66 32.07 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 34.7 mt -82.85 -24.06 33.42 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.194 -0.942 . . . . 0.0 112.892 166.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 70.2 m . . . . . 0 N--CA 1.452 -0.338 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 170.257 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 t0 . . . . . 0 CA--C 1.536 0.409 0 N-CA-C 111.48 0.178 . . . . 0.0 111.48 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -72.14 -45.01 62.23 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 117.568 -1.206 . . . . 0.0 111.767 172.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 42.6 tp -49.47 -63.36 1.13 Allowed 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 118.995 0.816 . . . . 0.0 111.791 176.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -60.8 -30.91 70.34 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.911 -1.118 . . . . 0.0 112.709 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.38 -38.03 84.1 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 175.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -60.33 -51.2 70.51 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 119.15 0.886 . . . . 0.0 111.131 173.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.5 mp -58.59 -42.26 84.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-N 119.107 0.867 . . . . 0.0 111.318 175.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.02 -20.97 63.24 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 115.344 1.609 . . . . 0.0 115.344 -178.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -98.05 -37.39 9.77 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.881 1.272 . . . . 0.0 113.218 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -73.12 -52.43 14.26 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.724 0.81 . . . . 0.0 112.979 173.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -83.83 159.18 21.44 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 122.4 1.095 . . . . 0.0 109.983 175.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -77.67 -84.41 0.07 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.423 -169.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -153.72 -61.6 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 117.961 -1.018 . . . . 0.0 110.405 -178.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -66.65 -38.33 18.83 Favored 'Trans proline' 0 C--N 1.352 0.761 0 CA-C-N 121.437 1.549 . . . . 0.0 110.731 170.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.14 -35.11 71.03 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 121.024 -1.047 . . . . 0.0 112.743 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 35.3 ttt180 -63.4 -47.62 81.23 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.879 1.272 . . . . 0.0 110.379 172.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.06 -34.72 73.77 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.258 1.408 . . . . 0.0 114.148 177.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -75.64 -32.8 60.37 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.356 1.078 . . . . 0.0 110.725 175.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.96 -46.69 64.73 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.734 -0.604 . . . . 0.0 110.968 -177.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.53 -35.35 77.34 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.37 -53.45 56.45 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.488 0.586 . . . . 0.0 112.064 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 88.4 mt -58.47 -34.1 70.5 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.246 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 44.1 ttp -65.53 -50.5 64.99 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.294 0.638 . . . . 0.0 112.469 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -64.65 -44.35 90.72 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.145 0.884 . . . . 0.0 112.172 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.2 -38.79 90.47 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.145 0.978 . . . . 0.0 111.426 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -62.92 -45.99 89.88 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.152 -0.968 . . . . 0.0 111.777 171.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 70.3 mt -64.96 -34.84 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 121.277 -0.89 . . . . 0.0 112.561 -177.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -61.51 -65.14 0.74 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.715 1.206 . . . . 0.0 110.356 169.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 12.4 m-30 -76.26 -2.94 33.87 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.893 1.277 . . . . 0.0 114.234 -171.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt . . . . . 0 N--CA 1.476 0.847 0 C-N-CA 125.636 1.575 . . . . 0.0 112.035 170.107 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.473 0.711 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -66.31 170.28 6.15 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.161 -0.962 . . . . 0.0 112.573 173.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.1 p -110.38 161.1 15.98 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.959 1.304 . . . . 0.0 113.418 176.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.9 t -123.27 135.56 62.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 125.701 1.6 . . . . 0.0 109.748 -175.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -80.42 173.66 12.38 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.571 1.549 . . . . 0.0 112.767 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.5 -28.73 32.61 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -170.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.8 m -128.88 43.42 3.15 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.588 1.955 . . . . 0.0 111.029 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.25 -122.12 5.84 Favored Glycine 0 CA--C 1.528 0.9 0 O-C-N 120.938 -1.101 . . . . 0.0 111.288 -174.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 56.12 -176.58 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.319 1.048 . . . . 0.0 113.562 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mt -110.1 133.63 53.01 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.214 -0.928 . . . . 0.0 109.575 173.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 12.8 mt -106.31 144.36 33.12 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 122.005 0.907 . . . . 0.0 110.693 169.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 23.4 mt -64.95 113.63 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 124.151 0.98 . . . . 0.0 110.238 -173.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -143.19 142.09 31.33 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.205 1.402 . . . . 0.0 111.344 -175.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 27.0 ttm180 -65.88 -25.49 67.2 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.507 1.123 . . . . 0.0 112.972 -173.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.43 -29.89 68.08 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 128.649 2.78 . . . . 0.0 112.334 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 82.1 mt -56.27 -39.06 57.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.336 1.054 . . . . 0.0 111.647 173.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -68.22 -35.88 78.66 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 121.006 -1.059 . . . . 0.0 112.362 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -66.23 -31.31 72.05 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.058 0.543 . . . . 0.0 111.251 173.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.36 -44.63 78.53 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.944 0.897 . . . . 0.0 111.457 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -63.87 -44.96 91.5 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 118.285 -0.864 . . . . 0.0 113.176 167.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -39.79 94.48 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 120.624 1.556 . . . . 0.0 112.453 -177.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.94 -13.05 42.8 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -113.95 -12.17 12.68 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.546 1.138 . . . . 0.0 113.241 172.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 34.0 mt -78.9 -39.53 34.72 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.385 0.993 . . . . 0.0 111.484 172.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.1 p . . . . . 0 N--CA 1.471 0.582 0 CA-C-N 118.986 0.812 . . . . 0.0 110.95 171.362 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.3 t0 . . . . . 0 N--CA 1.468 0.466 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 19.5 ptt-85 -64.74 -31.08 72.15 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 117.846 -1.073 . . . . 0.0 113.356 171.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.21 -61.27 2.48 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.563 1.074 . . . . 0.0 109.995 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -59.35 -29.69 67.85 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.508 1.123 . . . . 0.0 113.189 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.03 -45.21 71.03 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.602 0.761 . . . . 0.0 112.183 173.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -53.42 -48.97 68.26 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.066 0.946 . . . . 0.0 112.597 176.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.438 HG22 ' HG3' ' A' ' 129' ' ' ARG . 3.9 mp -62.12 -38.62 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 O-C-N 121.372 -0.83 . . . . 0.0 111.864 175.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.66 -24.63 61.06 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -83.64 -42.37 16.76 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.684 1.194 . . . . 0.0 112.486 173.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -79.12 -46.94 17.01 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.702 1.201 . . . . 0.0 113.04 -178.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.484 HD12 ' HB1' ' A' ' 128' ' ' ALA . 2.2 mm? -88.27 171.77 9.93 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 122.654 1.216 . . . . 0.0 110.935 177.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.92 -108.16 0.09 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.736 1.215 . . . . 0.0 111.749 -176.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.445 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 47.7 tt0 -126.68 -63.9 0.02 OUTLIER Pre-proline 0 N--CA 1.47 0.552 0 O-C-N 120.337 -1.477 . . . . 0.0 108.975 -175.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.445 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 72.5 Cg_endo -68.78 -38.37 10.35 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 120.764 1.309 . . . . 0.0 111.568 173.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.484 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -59.9 -29.65 68.49 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.028 -1.045 . . . . 0.0 111.957 177.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.438 ' HG3' HG22 ' A' ' 120' ' ' ILE . 51.6 ttt180 -72.73 -45.45 58.63 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.942 0.401 . . . . 0.0 110.183 177.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.57 -35.49 80.73 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 115.459 -0.792 . . . . 0.0 113.762 176.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -72.65 -34.59 67.38 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.467 1.134 . . . . 0.0 110.747 175.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.03 -44.02 61.31 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.167 0.587 . . . . 0.0 111.285 -174.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -69.6 -36.18 75.98 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 119.032 -0.508 . . . . 0.0 112.074 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.66 -53.56 54.55 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.067 0.849 . . . . 0.0 111.782 174.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.4 mt -56.29 -35.29 67.34 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.679 0.792 . . . . 0.0 111.501 175.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 53.4 ttp -66.86 -51.3 57.12 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.434 0.693 . . . . 0.0 112.561 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -64.44 -40.8 96.44 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.436 -0.79 . . . . 0.0 111.66 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.06 -43.68 98.3 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.84 1.256 . . . . 0.0 111.377 176.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -60.35 -45.21 94.28 Favored 'General case' 0 C--O 1.221 -0.426 0 O-C-N 121.636 -0.665 . . . . 0.0 111.241 173.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 85.5 mt -67.94 -34.34 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.743 0.817 . . . . 0.0 112.861 -178.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -69.58 -49.69 51.75 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.617 0.767 . . . . 0.0 111.406 172.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 14.0 m-30 -79.93 -0.42 34.96 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.125 -0.984 . . . . 0.0 113.49 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt . . . . . 0 N--CA 1.483 1.197 0 C-N-CA 126.441 1.896 . . . . 0.0 113.316 177.852 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.4 t . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -50.08 156.66 0.75 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 128.509 2.724 . . . . 0.0 114.432 175.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.7 p -106.27 157.81 17.32 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.547 1.139 . . . . 0.0 112.995 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.5 t -124.45 129.92 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.374 1.47 . . . . 0.0 110.0 -171.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -77.32 171.01 15.53 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.985 2.114 . . . . 0.0 113.138 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.14 2.71 0.08 Allowed 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 127.72 2.408 . . . . 0.0 116.373 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 42.7 m -154.05 37.26 0.44 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.529 1.931 . . . . 0.0 111.31 169.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.84 -103.84 3.1 Favored Glycine 0 CA--C 1.527 0.789 0 O-C-N 120.872 -1.143 . . . . 0.0 111.854 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 49.89 -166.89 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.304 1.442 . . . . 0.0 112.88 -172.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mt -122.56 129.99 52.53 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 120.598 -1.314 . . . . 0.0 108.214 162.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.8 mt -99.66 143.3 30.05 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.996 0.903 . . . . 0.0 111.388 174.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 48.3 mm -61.31 125.04 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 123.901 0.88 . . . . 0.0 110.91 -174.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.5 p -155.39 150.6 26.9 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.487 1.915 . . . . 0.0 110.335 -168.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 30.3 ttm180 -88.45 -12.16 43.91 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 -168.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -67.87 -29.38 68.48 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 117.613 -1.184 . . . . 0.0 111.803 169.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 45.4 mm -51.62 -36.56 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 119.972 1.26 . . . . 0.0 112.064 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.4 ttt85 -74.58 -41.16 60.99 Favored 'General case' 0 CA--C 1.521 -0.15 0 O-C-N 121.007 -1.058 . . . . 0.0 110.775 178.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -64.78 -28.28 69.47 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.437 176.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 tt -64.77 -47.75 77.01 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.478 1.511 . . . . 0.0 110.866 174.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -66.68 -42.3 86.75 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.61 -0.682 . . . . 0.0 112.451 171.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -58.12 -43.91 87.44 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.574 1.079 . . . . 0.0 112.842 177.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.69 -34.33 75.57 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -175.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -88.04 -32.19 18.91 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.525 1.13 . . . . 0.0 113.001 178.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.8 mt -57.21 -51.06 70.87 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.824 1.193 . . . . 0.0 110.696 170.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 62.6 m . . . . . 0 CA--C 1.539 0.527 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 177.694 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.71 -39.34 84.37 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.42 -0.8 . . . . 0.0 112.94 172.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 35.2 tp -59.65 -57.71 11.77 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.542 1.065 . . . . 0.0 111.917 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -23.24 66.76 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.61 -31.14 32.63 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.316 1.046 . . . . 0.0 113.04 176.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.66 -44.45 56.77 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.546 0.739 . . . . 0.0 110.484 173.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 15.3 mt -57.59 -41.26 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 CA-C-O 121.525 0.679 . . . . 0.0 111.533 173.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.46 -21.31 66.63 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -95.02 -23.12 17.5 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 176.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -90.64 -40.35 11.95 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 35.3 mt -83.81 179.7 7.51 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.776 2.031 . . . . 0.0 113.301 177.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -91.43 -96.05 0.12 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.63 1.172 . . . . 0.0 112.167 -173.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.489 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 35.3 tt0 -140.85 -62.22 0.02 OUTLIER Pre-proline 0 N--CA 1.47 0.558 0 O-C-N 120.716 -1.24 . . . . 0.0 109.956 170.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.489 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 59.8 Cg_endo -65.57 -35.76 36.73 Favored 'Trans proline' 0 C--N 1.352 0.761 0 CA-C-N 121.276 1.491 . . . . 0.0 111.106 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -47.84 -47.74 31.25 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.999 1.319 . . . . 0.0 112.628 168.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -62.76 -48.03 80.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.965 1.306 . . . . 0.0 110.458 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.13 -34.77 74.43 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.568 1.08 . . . . 0.0 113.649 178.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -75.77 -33.48 60.2 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.483 1.142 . . . . 0.0 110.986 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.2 61.2 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.691 -0.63 . . . . 0.0 111.055 -174.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -67.05 -36.84 82.94 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.967 173.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.11 -55.18 35.45 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 119.378 0.99 . . . . 0.0 111.312 175.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 92.4 mt -53.79 -36.63 62.64 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.283 1.033 . . . . 0.0 111.847 174.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 40.9 ttp -67.2 -50.6 60.3 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.648 0.658 . . . . 0.0 112.353 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -43.58 93.39 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.454 -0.778 . . . . 0.0 111.271 177.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -39.09 93.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.604 1.562 . . . . 0.0 112.377 178.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -64.06 -39.99 95.28 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.167 -0.958 . . . . 0.0 111.985 173.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 83.9 mt -72.18 -35.07 51.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.233 1.013 . . . . 0.0 112.059 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 62.0 t0 -62.42 -62.59 1.65 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.07 2.148 . . . . 0.0 110.81 172.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -78.87 -1.21 33.96 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -177.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 23.0 ttmt . . . . . 0 N--CA 1.482 1.13 0 C-N-CA 124.715 1.206 . . . . 0.0 112.878 -173.564 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.48 1.029 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -77.53 -176.02 4.07 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.917 1.287 . . . . 0.0 112.083 176.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.5 p -147.36 166.42 27.19 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 120.574 -1.328 . . . . 0.0 112.772 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 p -135.66 130.28 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.063 1.745 . . . . 0.0 111.379 -165.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -75.38 168.97 18.98 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.701 2.0 . . . . 0.0 112.548 172.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -50.29 -17.25 0.42 Allowed 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 -176.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.9 m -139.09 41.9 2.09 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 127.411 2.285 . . . . 0.0 111.674 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 92.38 -123.93 7.48 Favored Glycine 0 C--N 1.35 1.338 0 O-C-N 119.524 -1.985 . . . . 0.0 110.372 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 62.7 m-20 55.92 -178.94 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.584 1.153 . . . . 0.0 112.677 -171.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.48 114.84 28.22 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 172.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 12.1 mt -83.49 148.39 27.26 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 122.161 0.981 . . . . 0.0 111.951 175.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 22.9 mt -66.51 101.19 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.612 1.165 . . . . 0.0 110.089 -173.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -145.96 138.96 25.84 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.652 1.581 . . . . 0.0 110.086 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 34.5 ttp180 -78.29 42.35 0.41 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.119 1.368 . . . . 0.0 113.739 -170.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.33 -59.59 2.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.292 1.037 . . . . 0.0 113.317 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.0 pt -54.31 -31.3 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.426 1.49 . . . . 0.0 114.297 -167.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -60.09 -40.43 89.58 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.644 -0.66 . . . . 0.0 112.299 176.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -73.82 -32.39 63.68 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.52 0.728 . . . . 0.0 109.741 -173.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.1 mp -60.77 -51.01 71.16 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.619 0.767 . . . . 0.0 110.885 167.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.6 m-30 -60.17 -45.27 93.67 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 118.382 -0.818 . . . . 0.0 112.292 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -62.68 -38.05 88.83 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.536 1.134 . . . . 0.0 112.659 178.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.11 -41.29 97.3 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.206 0.912 . . . . 0.0 111.902 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -84.61 -28.24 26.65 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.571 -0.705 . . . . 0.0 112.665 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 43.8 mt -59.01 -33.29 70.55 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.643 1.11 . . . . 0.0 111.195 166.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.2 m . . . . . 0 CA--C 1.544 0.732 0 C-N-CA 125.595 1.558 . . . . 0.0 113.952 175.677 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.471 0.578 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 33.2 ptt180 -70.09 -32.68 70.86 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 118.625 -0.702 . . . . 0.0 112.881 171.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.4 tt -57.52 -60.38 3.75 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.966 0.803 . . . . 0.0 109.991 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.56 -31.92 66.6 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.804 0.841 . . . . 0.0 112.162 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.4 -37.52 80.41 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.118 0.567 . . . . 0.0 112.173 -177.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -61.18 -50.13 74.37 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.492 171.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.402 HD12 ' H ' ' A' ' 120' ' ' ILE . 4.3 mp -60.15 -39.49 80.68 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.413 0 CA-C-N 119.161 0.891 . . . . 0.0 111.578 177.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.85 -21.46 63.35 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -99.59 -21.38 15.9 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.73 1.212 . . . . 0.0 114.167 176.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -104.68 -38.12 6.83 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 120.357 -0.537 . . . . 0.0 112.237 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -87.67 156.63 19.38 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 122.491 1.139 . . . . 0.0 110.096 169.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.61 -88.47 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.944 0.898 . . . . 0.0 112.371 -166.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -150.07 -58.48 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.735 0 O-C-N 121.096 -1.003 . . . . 0.0 111.01 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -69.66 -36.24 11.43 Favored 'Trans proline' 0 C--N 1.353 0.776 0 CA-C-N 121.637 1.621 . . . . 0.0 111.113 167.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.97 -39.46 81.81 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 120.945 -1.097 . . . . 0.0 111.847 173.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 43.2 ttt180 -60.4 -51.24 70.33 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.211 1.405 . . . . 0.0 110.167 172.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -60.0 -31.02 71.32 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.018 1.294 . . . . 0.0 114.57 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.68 -30.23 41.05 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.768 1.284 . . . . 0.0 111.039 173.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.92 -44.3 55.51 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.414 -0.804 . . . . 0.0 111.138 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -66.99 -34.78 78.5 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 174.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.54 -56.36 22.27 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.003 0.521 . . . . 0.0 111.206 172.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.9 mp -58.45 -33.18 69.44 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.568 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 49.8 ttp -63.3 -48.21 79.03 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.708 0.803 . . . . 0.0 112.887 175.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -75.36 -29.54 59.94 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 120.761 -1.212 . . . . 0.0 112.775 176.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -41.99 76.63 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 124.873 1.269 . . . . 0.0 110.703 -178.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -35.24 79.63 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.687 -0.633 . . . . 0.0 111.072 176.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 87.8 mt -65.77 -40.31 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.797 0.839 . . . . 0.0 110.952 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -60.01 -19.28 51.73 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.442 1.097 . . . . 0.0 113.918 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -118.77 3.84 11.6 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.414 1.485 . . . . 0.0 114.385 176.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 11.9 tppt? . . . . . 0 N--CA 1.48 1.058 0 C-N-CA 124.663 1.185 . . . . 0.0 112.234 -177.623 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.3 t . . . . . 0 CA--C 1.551 0.981 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -51.48 170.27 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 129.388 3.075 . . . . 0.0 115.517 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.6 p -107.52 162.89 13.53 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.449 1.5 . . . . 0.0 113.82 173.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.6 t -130.07 135.88 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.106 1.762 . . . . 0.0 109.728 -173.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -80.2 174.77 11.26 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.445 1.498 . . . . 0.0 112.406 177.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.52 -13.31 1.47 Allowed 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 116.279 1.955 . . . . 0.0 116.279 -172.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 9.4 m -151.7 54.54 0.84 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.12 1.768 . . . . 0.0 111.027 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.0 -120.8 5.4 Favored Glycine 0 CA--C 1.527 0.795 0 O-C-N 121.191 -0.943 . . . . 0.0 111.049 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 55.1 -178.81 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.107 0 CA-C-N 118.067 0.933 . . . . 0.0 112.329 -168.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -108.82 123.4 48.99 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.555 -1.341 . . . . 0.0 108.098 166.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.8 mt -87.08 147.79 25.53 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 120.253 1.388 . . . . 0.0 111.06 173.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 42.5 mm -67.67 95.93 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.495 1.118 . . . . 0.0 110.932 -176.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.7 p -136.2 142.78 44.13 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.085 1.354 . . . . 0.0 110.804 173.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.5 ttm180 -68.52 13.13 0.1 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.331 1.452 . . . . 0.0 114.805 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -62.88 -63.44 1.21 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.529 1.531 . . . . 0.0 112.495 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 45.7 pt -55.53 -26.88 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 126.236 1.814 . . . . 0.0 115.644 -169.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -65.79 -33.33 75.61 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.932 -1.105 . . . . 0.0 112.53 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -71.5 -35.44 70.77 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.527 0.731 . . . . 0.0 110.422 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tt -63.99 -49.46 72.4 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.059 1.344 . . . . 0.0 110.595 175.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -58.04 -46.83 84.71 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.047 -0.978 . . . . 0.0 113.154 170.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -64.43 -37.94 89.27 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 120.96 1.709 . . . . 0.0 112.148 -178.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.48 -41.51 89.93 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.473 -0.767 . . . . 0.0 112.361 176.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -89.26 -13.55 37.88 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 67.3 mt -74.64 -35.78 62.87 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.613 1.097 . . . . 0.0 111.455 163.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.9 t . . . . . 0 N--CA 1.471 0.6 0 C-N-CA 123.798 0.839 . . . . 0.0 111.39 170.827 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 21.6 t70 . . . . . 0 N--CA 1.47 0.538 0 CA-C-O 121.489 0.662 . . . . 0.0 111.442 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -72.88 -42.39 63.7 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.496 0.718 . . . . 0.0 111.642 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.435 ' O ' HD12 ' A' ' 120' ' ' ILE . 57.3 tp -51.45 -59.93 3.7 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.909 0.883 . . . . 0.0 111.875 174.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.7 ppt_? -64.57 -20.95 66.55 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.03 -1.044 . . . . 0.0 113.526 -177.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -74.47 -45.84 43.5 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 124.123 0.889 . . . . 0.0 112.181 169.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -57.43 -50.9 71.53 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 118.962 0.801 . . . . 0.0 112.284 177.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.435 HD12 ' O ' ' A' ' 116' ' ' LEU . 4.0 mp -59.79 -41.78 86.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 119.587 1.085 . . . . 0.0 111.598 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.07 -32.8 73.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.41 33.06 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.179 -0.951 . . . . 0.0 110.645 175.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -71.61 -53.23 14.34 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.257 0.623 . . . . 0.0 112.303 -174.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.1 mt -81.1 166.54 20.61 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.162 0.506 . . . . 0.0 111.566 174.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -85.12 -87.46 0.12 Allowed 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -165.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.427 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 20.8 tt0 -143.02 -62.83 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.127 1.371 . . . . 0.0 109.782 169.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.427 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 63.2 Cg_endo -64.54 -37.23 39.03 Favored 'Trans proline' 0 C--N 1.356 0.926 0 CA-C-N 121.993 1.748 . . . . 0.0 112.27 177.063 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.04 -38.37 65.14 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.028 -1.045 . . . . 0.0 112.529 172.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -49.27 78.42 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.959 1.704 . . . . 0.0 110.557 176.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.8 -32.83 70.83 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 126.771 2.129 . . . . 0.0 114.32 175.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -78.26 -30.59 48.68 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.721 1.26 . . . . 0.0 110.909 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.76 -46.44 62.94 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.841 0.746 . . . . 0.0 111.306 -177.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.8 pp -64.9 -39.36 93.41 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.755 0.422 . . . . 0.0 111.898 174.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.62 -52.69 62.35 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.654 -0.654 . . . . 0.0 112.308 175.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.5 -29.45 69.09 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 117.877 -1.058 . . . . 0.0 111.817 176.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 46.3 ttp -66.65 -50.91 61.42 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.475 1.034 . . . . 0.0 111.771 174.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -67.68 -38.78 84.19 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.301 -0.874 . . . . 0.0 112.127 178.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.18 -41.21 94.84 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.988 1.315 . . . . 0.0 112.016 176.063 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -59.71 -37.51 79.08 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 121.331 -0.856 . . . . 0.0 111.503 172.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 84.1 mt -72.79 -40.98 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 123.834 0.854 . . . . 0.0 112.004 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -57.79 -51.12 70.88 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.528 1.131 . . . . 0.0 111.289 170.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 7.5 m-30 -89.13 11.38 18.75 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.384 1.074 . . . . 0.0 113.289 -176.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt . . . . . 0 N--CA 1.481 1.097 0 C-N-CA 124.355 1.062 . . . . 0.0 112.358 178.725 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.6 t . . . . . 0 CA--C 1.549 0.914 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -65.47 164.6 13.59 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.61 1.564 . . . . 0.0 112.205 177.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.7 p -120.36 156.15 31.93 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.702 1.201 . . . . 0.0 112.517 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.4 t -121.62 128.85 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 125.77 1.628 . . . . 0.0 108.624 -173.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -76.61 179.84 5.73 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.291 1.036 . . . . 0.0 112.636 176.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.73 -29.25 17.78 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 -168.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.3 m -143.55 84.85 1.82 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.654 1.582 . . . . 0.0 109.22 169.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 67.15 -124.3 22.63 Favored Glycine 0 CA--C 1.533 1.199 0 O-C-N 122.07 -0.394 . . . . 0.0 113.086 -177.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 57.31 178.92 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.858 1.263 . . . . 0.0 113.235 -168.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -113.05 125.76 54.74 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 164.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.6 mt -85.7 158.56 20.02 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 118.848 0.749 . . . . 0.0 110.228 169.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 39.8 mm -69.77 119.81 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.421 0.688 . . . . 0.0 110.437 179.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.7 p -147.46 162.16 39.6 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.733 0.813 . . . . 0.0 111.383 177.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -92.05 -19.79 21.98 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.922 -0.486 . . . . 0.0 111.815 -175.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.6 -29.5 37.98 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 173.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.0 mm -55.05 -34.93 33.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 O-C-N 120.794 -1.191 . . . . 0.0 111.433 -177.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -84.77 -18.67 34.33 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 121.171 -0.956 . . . . 0.0 111.613 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -73.77 -30.04 62.54 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.208 0.603 . . . . 0.0 110.501 173.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.8 mp -66.54 -57.01 8.18 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.428 0.558 . . . . 0.0 110.853 171.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -53.66 -46.55 70.63 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.346 177.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -60.66 -40.31 91.59 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.517 1.053 . . . . 0.0 112.715 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.41 -46.29 87.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.139 -0.975 . . . . 0.0 112.333 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -78.78 -21.12 48.3 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.0 mt -69.05 -37.1 78.37 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 119.439 1.018 . . . . 0.0 112.574 171.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.479 1.004 0 CA-C-N 119.152 0.887 . . . . 0.0 112.154 171.824 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 . . . . . 0 CA--C 1.532 0.285 0 CA-C-O 120.487 0.184 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -72.77 -37.6 67.57 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 117.998 -1.001 . . . . 0.0 111.577 -176.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 52.3 tp -54.98 -63.67 1.08 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.524 0.73 . . . . 0.0 111.558 173.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.76 -22.28 66.83 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 117.523 -1.227 . . . . 0.0 113.427 -177.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.92 -44.71 54.23 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 124.21 0.944 . . . . 0.0 112.287 168.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -53.17 -50.53 64.4 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.75 1.22 . . . . 0.0 112.315 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.0 mp -60.72 -39.37 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 O-C-N 121.63 -0.669 . . . . 0.0 111.955 177.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -75.2 -15.95 60.52 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -98.57 -35.39 10.23 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.127 1.371 . . . . 0.0 113.296 175.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -82.91 -39.41 21.53 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.917 0.887 . . . . 0.0 112.214 175.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 83.6 mt -93.95 168.32 11.04 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.387 1.089 . . . . 0.0 112.285 168.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.9 -91.35 0.09 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.63 1.172 . . . . 0.0 112.31 -164.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.444 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 19.5 tt0 -146.07 -55.12 0.02 OUTLIER Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.932 1.293 . . . . 0.0 111.281 173.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.444 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 57.6 Cg_endo -68.34 -43.32 4.49 Favored 'Trans proline' 0 C--N 1.356 0.949 0 CA-C-N 121.921 1.722 . . . . 0.0 111.726 173.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -48.92 -39.47 26.27 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.648 1.579 . . . . 0.0 113.142 173.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.87 -45.13 95.79 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.183 1.393 . . . . 0.0 111.355 176.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.95 -35.17 82.11 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 125.485 1.517 . . . . 0.0 113.707 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -73.73 -32.92 64.1 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.362 1.081 . . . . 0.0 110.68 174.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.09 -45.0 62.35 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.173 0.589 . . . . 0.0 111.565 -176.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.07 -37.06 80.84 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.338 0.655 . . . . 0.0 112.259 175.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.9 -51.51 66.67 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.304 0.502 . . . . 0.0 112.012 173.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.7 mp -58.37 -30.1 66.52 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 117.874 -1.06 . . . . 0.0 111.646 175.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.432 ' SD ' HD11 ' A' ' 140' ' ' ILE . 0.0 OUTLIER -63.78 -57.36 10.17 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.067 0.848 . . . . 0.0 111.483 175.682 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.72 -37.24 84.29 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.215 -0.928 . . . . 0.0 112.395 179.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -38.95 92.71 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.189 1.396 . . . . 0.0 112.203 173.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -65.32 -43.19 91.81 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.368 -0.832 . . . . 0.0 111.27 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 136' ' ' MET . 55.6 mt -62.43 -38.76 82.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-O 118.406 -0.807 . . . . 0.0 112.419 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -57.2 -23.05 45.17 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.963 0.905 . . . . 0.0 112.786 175.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -118.1 6.6 12.08 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.381 1.472 . . . . 0.0 114.455 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? . . . . . 0 N--CA 1.478 0.935 0 C-N-CA 124.64 1.176 . . . . 0.0 113.857 -176.92 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.4 t . . . . . 0 CA--C 1.54 0.593 0 CA-C-O 122.785 1.279 . . . . 0.0 109.71 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -95.6 161.19 14.15 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 127.399 2.279 . . . . 0.0 112.228 177.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 p -92.23 155.35 18.04 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.597 1.559 . . . . 0.0 113.259 171.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 27.7 m -131.75 159.48 43.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 125.998 1.719 . . . . 0.0 110.438 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -91.35 -178.95 5.27 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.043 1.737 . . . . 0.0 112.715 -177.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.72 15.62 0.1 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.113 1.765 . . . . 0.0 115.528 -173.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.5 m -160.49 38.93 0.17 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.966 2.107 . . . . 0.0 110.547 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.69 -122.51 7.16 Favored Glycine 0 CA--C 1.529 0.961 0 O-C-N 121.035 -1.041 . . . . 0.0 110.981 -166.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 57.07 -174.9 0.07 Allowed 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 118.182 0.991 . . . . 0.0 112.996 -171.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 87' ' ' LEU . 4.2 mt -108.58 134.56 51.17 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.942 0.897 . . . . 0.0 108.985 171.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.7 164.3 12.64 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.715 0.806 . . . . 0.0 111.374 175.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 39.3 mm -66.43 108.86 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.025 0.93 . . . . 0.0 111.231 175.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 10.1 t -155.93 162.96 40.31 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.838 1.255 . . . . 0.0 111.675 170.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -94.26 9.09 39.42 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -57.03 -46.14 82.62 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 121.156 -0.965 . . . . 0.0 111.981 172.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.5 pt -56.46 -33.33 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.519 1.128 . . . . 0.0 113.622 178.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 40.0 ttt85 -61.33 -45.1 95.84 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 118.696 0.68 . . . . 0.0 110.706 173.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -68.01 -33.4 74.55 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.153 0.581 . . . . 0.0 111.334 -178.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.3 mp -62.82 -52.56 62.68 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.843 0.747 . . . . 0.0 112.017 168.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.71 -42.9 98.16 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.306 0.957 . . . . 0.0 112.749 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -62.94 -43.88 97.6 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.526 1.057 . . . . 0.0 111.717 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.81 -36.72 79.78 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -90.2 -24.77 20.91 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 31.6 mt -63.59 -44.63 93.46 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 119.308 0.958 . . . . 0.0 111.544 173.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.9 t . . . . . 0 N--CA 1.476 0.833 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 176.58 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.3 t0 . . . . . 0 N--CA 1.468 0.475 0 CA-C-O 121.265 0.555 . . . . 0.0 111.816 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 18.3 mmt85 -64.2 -43.62 94.46 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.112 0.565 . . . . 0.0 110.721 171.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.452 ' O ' HD12 ' A' ' 120' ' ' ILE . 54.8 tp -56.1 -56.16 24.18 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.434 0.694 . . . . 0.0 112.153 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -55.77 -37.01 67.98 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 119.256 0.935 . . . . 0.0 112.285 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.71 -41.35 92.41 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.807 0.843 . . . . 0.0 112.431 178.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -61.58 -49.04 78.26 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 118.558 -0.734 . . . . 0.0 111.958 173.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.452 HD12 ' O ' ' A' ' 116' ' ' LEU . 3.5 mp -57.94 -45.81 87.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.794 1.179 . . . . 0.0 111.195 175.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.84 -32.96 74.9 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -80.64 -45.77 16.7 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.997 0.817 . . . . 0.0 112.708 177.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -66.0 -51.87 54.44 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.993 1.317 . . . . 0.0 112.985 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.508 HD12 ' HB1' ' A' ' 128' ' ' ALA . 3.7 mm? -75.9 -160.92 0.15 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.836 1.255 . . . . 0.0 112.102 -178.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.54 -105.48 0.39 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.08 1.352 . . . . 0.0 109.239 173.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.405 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 56.7 tt0 -127.54 -64.38 0.02 OUTLIER Pre-proline 0 N--CA 1.468 0.464 0 O-C-N 120.126 -1.609 . . . . 0.0 110.162 -176.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.405 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 77.6 Cg_endo -67.08 -30.95 37.8 Favored 'Trans proline' 0 C--N 1.349 0.574 0 CA-C-N 121.206 1.467 . . . . 0.0 111.561 173.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.508 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -63.6 -35.41 80.41 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 120.794 -1.191 . . . . 0.0 112.267 172.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -64.55 -47.3 79.3 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.971 0.908 . . . . 0.0 110.125 170.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.8 -34.54 78.1 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.138 1.352 . . . . 0.0 114.008 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -33.15 64.84 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.812 1.306 . . . . 0.0 110.041 175.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.38 -43.42 60.62 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.372 0.669 . . . . 0.0 111.558 -174.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -69.49 -35.54 75.67 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.094 0.557 . . . . 0.0 112.439 174.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.84 -50.51 70.65 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 122.937 0.495 . . . . 0.0 111.923 172.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.7 mp -57.79 -31.98 67.1 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 117.619 -1.182 . . . . 0.0 111.916 173.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 2.3 tpt -64.53 -52.32 58.34 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.611 1.096 . . . . 0.0 111.137 174.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 38.3 mm-40 -62.4 -43.08 99.66 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.104 0.562 . . . . 0.0 112.46 177.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -41.82 86.23 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.64 1.176 . . . . 0.0 111.985 -179.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -60.88 -42.68 98.4 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.852 0.751 . . . . 0.0 111.332 170.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 68.3 mt -62.5 -28.74 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-O 119.182 -0.437 . . . . 0.0 111.089 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -76.9 -31.21 56.57 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.656 -176.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.3 p90 -102.55 3.31 37.28 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 174.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 9.9 ttpt . . . . . 0 N--CA 1.484 1.251 0 C-N-CA 125.465 1.506 . . . . 0.0 113.585 -179.383 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 CA--C 1.551 1.002 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -67.66 161.88 24.88 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.803 1.241 . . . . 0.0 112.788 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 73.4 p -147.52 163.17 37.41 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.958 0.903 . . . . 0.0 113.201 -178.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.8 p -127.99 130.2 69.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.675 1.59 . . . . 0.0 111.975 -167.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -82.75 178.9 7.96 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.653 1.581 . . . . 0.0 113.336 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.43 -7.01 0.2 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.483 2.313 . . . . 0.0 117.203 -173.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.3 m -161.53 75.84 0.5 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 126.041 1.736 . . . . 0.0 109.864 161.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 73.58 -127.3 10.47 Favored Glycine 0 CA--C 1.528 0.874 0 O-C-N 121.169 -0.957 . . . . 0.0 110.939 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 57.84 175.95 0.05 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.357 1.063 . . . . 0.0 111.372 -166.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.4 125.84 52.2 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.629 -1.294 . . . . 0.0 108.26 167.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.9 mt -84.29 166.33 17.56 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 118.925 0.784 . . . . 0.0 111.959 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 38.2 mm -73.49 94.96 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 124.583 1.153 . . . . 0.0 112.127 -173.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 46.3 p -138.03 148.05 44.74 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.933 1.693 . . . . 0.0 111.58 177.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.31 6.04 48.33 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -174.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -59.48 -39.01 82.37 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.979 0.912 . . . . 0.0 110.906 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 32.8 pt -55.53 -37.09 44.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 125.792 1.637 . . . . 0.0 113.356 176.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 -61.18 -55.22 34.73 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.238 1.015 . . . . 0.0 109.888 176.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -66.48 -31.81 72.78 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.534 0.733 . . . . 0.0 112.305 -179.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 8.7 mt -62.51 -53.4 55.26 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.165 0.986 . . . . 0.0 112.497 172.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -59.8 -46.24 89.83 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.68 0.673 . . . . 0.0 110.867 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -65.16 -34.17 77.74 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -177.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.02 -44.7 79.62 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.149 -0.97 . . . . 0.0 112.664 173.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -74.62 -31.22 61.93 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.495 -0.753 . . . . 0.0 112.293 179.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.0 mt -63.49 -39.84 95.5 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.814 0.734 . . . . 0.0 110.465 169.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 172.155 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 110.637 -0.134 . . . . 0.0 110.637 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -57.63 -45.16 85.76 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.872 0.869 . . . . 0.0 111.642 174.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 38.7 tp -62.65 -56.57 16.56 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.515 0.726 . . . . 0.0 112.461 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -22.52 65.54 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.179 -0.951 . . . . 0.0 113.328 -177.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -72.64 -40.17 66.61 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.137 0.975 . . . . 0.0 113.126 174.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -42.9 74.06 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.647 0.658 . . . . 0.0 110.486 177.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 17.8 mt -57.06 -40.97 76.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 121.575 -0.703 . . . . 0.0 110.955 173.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.85 -23.15 64.2 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -79.34 -29.63 42.33 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 174.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -107.37 -37.5 6.21 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -170.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -88.51 156.72 18.93 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.291 1.436 . . . . 0.0 111.664 175.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -75.98 -69.03 0.52 Allowed 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 -157.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -165.21 -56.82 0.01 OUTLIER Pre-proline 0 N--CA 1.479 0.985 0 C-N-CA 127.147 2.179 . . . . 0.0 109.794 168.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -69.78 -39.69 6.16 Favored 'Trans proline' 0 C--N 1.356 0.927 0 CA-C-N 121.446 1.552 . . . . 0.0 111.498 173.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.34 -40.26 61.72 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.75 1.22 . . . . 0.0 112.35 175.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -60.23 -48.36 82.04 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.493 1.517 . . . . 0.0 111.163 174.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.52 -34.05 74.23 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.52 1.533 . . . . 0.0 113.625 177.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -73.83 -34.46 64.56 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.437 1.118 . . . . 0.0 110.906 175.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.78 -46.61 68.29 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 122.876 0.47 . . . . 0.0 110.902 -176.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -71.08 -33.57 70.33 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 175.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.17 -53.02 59.82 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 118.826 0.739 . . . . 0.0 112.257 173.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.16 -34.22 70.06 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.673 0.789 . . . . 0.0 111.242 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 48.3 ttp -64.93 -52.93 53.68 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.601 0.761 . . . . 0.0 112.37 175.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -64.81 -37.64 88.3 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.587 -0.696 . . . . 0.0 112.428 178.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -43.35 94.85 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.344 1.058 . . . . 0.0 112.309 175.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . 0.437 ' O ' ' HE2' ' A' ' 143' ' ' LYS . 73.4 t80 -59.93 -39.47 85.6 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.44 -0.788 . . . . 0.0 111.465 175.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 88.3 mt -72.16 -41.87 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.079 1.351 . . . . 0.0 112.867 176.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -55.0 -53.24 58.26 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.134 1.374 . . . . 0.0 110.028 172.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -79.52 7.93 7.29 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 120.935 -1.103 . . . . 0.0 113.231 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.437 ' HE2' ' O ' ' A' ' 139' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.61 0 C-N-CA 124.093 0.957 . . . . 0.0 112.679 166.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.8 t . . . . . 0 N--CA 1.468 0.455 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -169.79 178.09 4.19 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.217 1.807 . . . . 0.0 110.4 -176.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 53.9 p -137.11 159.67 41.21 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.739 1.216 . . . . 0.0 112.644 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.0 p -128.33 130.92 69.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 126.52 1.928 . . . . 0.0 111.52 -169.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -77.95 170.03 17.28 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 126.203 1.801 . . . . 0.0 111.644 173.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.34 -1.79 0.15 Allowed 'General case' 0 CA--C 1.558 1.265 0 N-CA-C 117.071 2.248 . . . . 0.0 117.071 -173.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 18.0 m -147.38 39.42 0.99 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.534 1.933 . . . . 0.0 112.094 175.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 86.94 -121.15 5.69 Favored Glycine 0 C--N 1.342 0.913 0 N-CA-C 109.951 -1.259 . . . . 0.0 109.951 -173.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 57.37 175.47 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.091 0.956 . . . . 0.0 112.764 -166.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.44 120.55 42.21 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 164.503 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.0 mt -84.15 161.0 20.76 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.14 0.882 . . . . 0.0 110.922 170.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 17.9 mt -75.17 99.08 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 124.301 1.04 . . . . 0.0 110.888 -173.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 31.9 p -113.18 155.48 24.94 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.842 0.857 . . . . 0.0 110.595 162.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.521 ' O ' ' HG2' ' A' ' 94' ' ' ARG . 1.5 tpm_? -72.02 -33.08 67.76 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.206 -0.934 . . . . 0.0 111.469 173.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.557 ' HA ' HD22 ' A' ' 95' ' ' ASN . 3.3 m-20 -53.36 -34.55 58.02 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 127.198 2.199 . . . . 0.0 113.447 -167.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 55.3 mt -44.38 -35.97 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 126.424 1.89 . . . . 0.0 112.782 173.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 91' ' ' ARG . 19.9 ptt85 -79.9 -24.92 40.8 Favored 'General case' 0 C--N 1.339 0.137 0 O-C-N 121.494 -0.754 . . . . 0.0 111.829 -173.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . 0.557 HD22 ' HA ' ' A' ' 92' ' ' ASP . 68.1 m-80 -73.61 -30.73 63.17 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.175 0.99 . . . . 0.0 110.019 175.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.4 -45.09 89.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.738 0.815 . . . . 0.0 111.425 172.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -60.99 -47.96 84.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 118.127 -0.94 . . . . 0.0 112.715 170.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.7 -41.67 97.9 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 120.355 1.434 . . . . 0.0 112.148 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.24 -22.68 63.33 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 177.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -106.31 -22.49 12.81 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.3 mt -64.05 -51.16 65.43 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.977 1.262 . . . . 0.0 109.833 171.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.8 m . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 172.725 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.7 t70 . . . . . 0 CA--C 1.541 0.633 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 38.8 ptt85 -73.5 -32.37 64.24 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 172.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 43.9 tp -65.23 -58.26 6.4 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.998 0.817 . . . . 0.0 111.013 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.85 -30.81 67.98 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.334 -0.854 . . . . 0.0 112.017 178.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.97 -44.05 81.47 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 122.89 0.476 . . . . 0.0 111.988 174.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -53.36 -56.4 17.03 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.341 1.057 . . . . 0.0 112.049 173.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.404 HD12 ' H ' ' A' ' 120' ' ' ILE . 4.2 mp -60.54 -41.03 86.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 121.637 -0.664 . . . . 0.0 111.562 177.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.18 -24.22 64.94 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.31 -33.2 16.19 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.96 0.904 . . . . 0.0 113.062 173.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.54 -48.84 14.43 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.397 1.479 . . . . 0.0 113.342 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -92.36 155.15 18.1 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.66 1.584 . . . . 0.0 111.049 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -76.42 -74.16 0.24 Allowed 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 114.967 -1.015 . . . . 0.0 113.47 -159.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -158.12 -58.43 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.704 0 C-N-CA 125.102 1.361 . . . . 0.0 110.377 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -70.16 -41.22 3.94 Favored 'Trans proline' 0 C--N 1.353 0.81 0 CA-C-N 121.047 1.41 . . . . 0.0 111.321 171.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.25 -37.47 67.26 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.926 1.29 . . . . 0.0 113.12 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 20.1 ttt-85 -56.59 -50.93 70.52 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.253 1.821 . . . . 0.0 111.104 172.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.72 -30.54 62.8 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.408 1.48 . . . . 0.0 114.376 177.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -80.77 -30.6 36.0 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.412 1.106 . . . . 0.0 111.598 173.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.55 -45.9 64.59 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.635 -0.666 . . . . 0.0 111.043 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -66.34 -34.46 78.03 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.253 0.621 . . . . 0.0 112.638 174.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.0 -54.38 35.26 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.123 0.569 . . . . 0.0 112.124 173.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 65.7 mt -55.31 -38.17 68.34 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.673 0.789 . . . . 0.0 111.051 178.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 60.1 ttp -63.43 -53.79 46.68 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.068 0.947 . . . . 0.0 112.014 177.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -69.71 -32.24 70.71 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.009 -1.057 . . . . 0.0 113.258 -178.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -45.13 95.43 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.679 1.192 . . . . 0.0 110.932 169.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -61.81 -45.08 95.4 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.155 -0.965 . . . . 0.0 111.639 174.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 71.1 mt -61.66 -38.41 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.173 0.989 . . . . 0.0 112.076 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -58.11 -54.74 43.49 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.373 1.469 . . . . 0.0 111.471 173.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -86.01 1.23 51.03 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 120.122 -1.611 . . . . 0.0 113.04 -174.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt . . . . . 0 N--CA 1.474 0.744 0 C-N-CA 124.22 1.008 . . . . 0.0 110.424 173.57 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.3 t . . . . . 0 N--CA 1.477 0.888 0 CA-C-O 121.601 0.715 . . . . 0.0 112.34 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -68.71 168.64 12.81 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.039 1.336 . . . . 0.0 114.205 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.1 p -84.68 162.59 19.64 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.369 1.468 . . . . 0.0 114.032 176.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.3 p -145.28 140.63 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 125.254 1.422 . . . . 0.0 111.122 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -80.96 174.65 11.41 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.459 1.904 . . . . 0.0 111.881 175.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.94 -6.94 0.64 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.71 2.004 . . . . 0.0 115.791 -177.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 26.9 m -156.87 59.34 0.53 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.56 1.944 . . . . 0.0 110.758 169.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.11 -115.98 4.22 Favored Glycine 0 C--N 1.341 0.85 0 O-C-N 121.18 -0.95 . . . . 0.0 111.482 178.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 128' ' ' ALA . 28.5 m-20 52.36 -177.03 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.748 1.619 . . . . 0.0 113.006 -174.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 87' ' ' LEU . 1.4 mt -114.6 119.46 36.84 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 120.342 -1.474 . . . . 0.0 109.777 167.32 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.8 mt -85.04 149.19 25.75 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.632 0.773 . . . . 0.0 110.246 172.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 15.0 mt -81.77 112.45 19.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 123.525 0.73 . . . . 0.0 110.137 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 6.4 t -155.0 176.51 12.44 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.3 1.04 . . . . 0.0 112.202 169.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -68.31 -15.15 63.46 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -165.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.17 -32.41 73.79 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.751 1.159 . . . . 0.0 112.234 -177.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.7 mt -63.51 -36.47 76.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.384 0.673 . . . . 0.0 111.743 -170.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -59.67 -52.02 67.29 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.619 -0.676 . . . . 0.0 110.494 170.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -62.43 -30.63 71.37 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.32 1.048 . . . . 0.0 112.296 -179.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -53.51 56.39 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.087 0.955 . . . . 0.0 111.759 174.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -65.62 -43.23 90.19 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.373 176.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -40.06 89.7 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.338 0.972 . . . . 0.0 112.167 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.92 -38.18 84.86 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.51 -0.744 . . . . 0.0 112.586 -178.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -93.28 -21.11 19.79 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 32.1 mt -66.35 -23.35 66.33 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.58 1.082 . . . . 0.0 113.489 173.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 41.6 t . . . . . 0 N--CA 1.473 0.693 0 O-C-N 121.719 -0.613 . . . . 0.0 112.44 164.833 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 . . . . . 0 CA--C 1.529 0.143 0 N-CA-C 110.43 -0.211 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -65.97 -37.45 86.02 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.625 174.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.5 tt -60.74 -65.03 0.75 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.377 0.989 . . . . 0.0 111.018 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.85 -27.61 69.29 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.42 1.088 . . . . 0.0 112.896 -176.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -75.25 -40.27 59.08 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -41.81 95.62 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 174.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 7.4 mt -62.08 -40.39 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.466 -0.771 . . . . 0.0 112.104 172.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.89 -28.0 64.22 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -77.84 -26.29 49.31 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.115 0.966 . . . . 0.0 113.55 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -107.71 -52.88 2.7 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.123 1.369 . . . . 0.0 114.176 -172.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -82.95 130.99 35.2 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.582 -1.324 . . . . 0.0 110.347 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -59.61 -77.27 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 114.287 -1.324 . . . . 0.0 112.881 -158.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -155.47 -61.27 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 125.021 1.328 . . . . 0.0 110.23 174.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -68.52 -37.67 12.51 Favored 'Trans proline' 0 C--N 1.352 0.752 0 CA-C-N 121.501 1.572 . . . . 0.0 110.485 172.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 86' ' ' ASN . . . -52.56 -44.29 65.77 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.145 0.978 . . . . 0.0 111.445 171.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -60.5 -51.47 69.31 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.608 1.963 . . . . 0.0 111.309 178.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -60.69 -30.1 71.58 Favored Glycine 0 CA--C 1.526 0.778 0 C-N-CA 125.387 1.47 . . . . 0.0 114.02 177.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -77.29 -33.7 55.72 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.565 1.183 . . . . 0.0 111.09 172.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.99 -46.15 68.79 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.343 -0.848 . . . . 0.0 111.045 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -69.04 -34.13 74.71 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 176.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.45 -53.16 56.46 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.251 0.621 . . . . 0.0 111.901 172.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.4 mt -55.57 -34.35 64.69 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.074 0.949 . . . . 0.0 111.413 175.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 36.9 ttp -65.86 -53.41 40.19 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 118.634 0.652 . . . . 0.0 112.12 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -59.72 -44.73 93.6 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.701 -0.624 . . . . 0.0 112.56 176.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -45.22 94.32 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.45 1.1 . . . . 0.0 111.389 178.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -58.62 -46.32 87.3 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.886 -0.509 . . . . 0.0 111.3 174.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 68.3 mt -61.76 -46.79 95.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 123.741 0.816 . . . . 0.0 111.32 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -65.62 -34.4 78.14 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.948 1.299 . . . . 0.0 112.252 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -91.75 -3.77 55.8 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 176.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt . . . . . 0 N--CA 1.476 0.861 0 O-C-N 120.995 -1.066 . . . . 0.0 113.115 -171.97 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.0 t . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -64.28 158.92 22.05 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.954 1.702 . . . . 0.0 113.915 -175.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.3 p -116.42 165.48 13.17 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -170.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.4 p -140.32 131.84 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 126.702 2.001 . . . . 0.0 111.145 -165.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -81.92 174.21 11.49 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.17 0.988 . . . . 0.0 112.069 172.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.71 -7.95 0.34 Allowed 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 117.136 2.273 . . . . 0.0 117.136 -171.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.4 t -145.84 48.64 1.23 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.716 1.207 . . . . 0.0 111.729 171.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.58 -121.83 5.55 Favored Glycine 0 CA--C 1.528 0.856 0 O-C-N 120.626 -1.296 . . . . 0.0 110.463 -174.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 57.9 -176.69 0.07 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.169 0.988 . . . . 0.0 111.32 -168.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -115.03 119.84 37.84 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.055 -1.028 . . . . 0.0 108.432 170.116 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.2 mt -84.2 135.73 34.25 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 119.156 0.889 . . . . 0.0 110.46 174.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 24.4 mt -66.14 102.14 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 124.265 1.026 . . . . 0.0 109.899 -174.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.6 p -142.46 156.67 45.19 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.228 1.811 . . . . 0.0 110.689 -175.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 30.0 ttt180 -66.38 -21.66 66.23 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -159.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -51.65 -45.73 63.45 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.54 1.536 . . . . 0.0 113.281 -174.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.0 pt -60.32 -28.31 41.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -177.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.3 ttt85 -65.03 -48.42 73.92 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.056 0.844 . . . . 0.0 110.941 173.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -69.88 -33.88 72.82 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.651 0.38 . . . . 0.0 111.885 -179.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.7 mp -56.64 -54.42 46.2 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 118.29 0.496 . . . . 0.0 112.026 171.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -64.46 -39.11 93.2 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.89 -30.82 62.82 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.752 1.16 . . . . 0.0 112.909 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.03 -30.77 71.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 175.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -91.0 -12.43 35.88 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 175.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.9 mt -80.32 -38.89 29.74 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 171.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.6 m . . . . . 0 N--CA 1.448 -0.538 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 178.604 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 t70 . . . . . 0 CA--C 1.543 0.675 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 115' ' ' ARG . 0.7 OUTLIER -76.72 -20.26 56.75 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 119.766 -1.834 . . . . 0.0 111.879 175.099 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.28 -58.0 7.81 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.777 0.431 . . . . 0.0 110.404 171.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -63.42 -32.35 73.76 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 121.169 -0.957 . . . . 0.0 112.744 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.45 -43.29 94.72 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.924 0.89 . . . . 0.0 112.436 176.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.52 -42.01 87.93 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.54 -0.725 . . . . 0.0 110.883 174.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 18.1 mt -56.77 -42.18 76.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 121.715 -0.615 . . . . 0.0 111.483 172.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -66.9 -19.74 65.78 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.73 -9.03 48.19 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.163 1.385 . . . . 0.0 114.652 171.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -125.42 -37.64 2.35 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -173.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -91.22 143.56 26.53 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.854 1.661 . . . . 0.0 110.236 174.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -64.8 -76.09 0.08 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -155.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -158.12 -58.52 0.02 OUTLIER Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 125.197 1.399 . . . . 0.0 109.812 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.3 -41.09 5.19 Favored 'Trans proline' 0 C--N 1.356 0.925 0 CA-C-N 121.411 1.539 . . . . 0.0 111.241 169.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.06 -41.7 65.08 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 120.765 -1.209 . . . . 0.0 112.536 175.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -60.15 -49.66 76.76 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.566 1.546 . . . . 0.0 110.915 173.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.86 -34.26 70.88 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 125.001 1.286 . . . . 0.0 114.196 175.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.11 -33.38 65.53 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.901 1.35 . . . . 0.0 110.201 175.356 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.73 -43.16 56.44 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.298 -0.876 . . . . 0.0 111.811 -174.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -68.36 -35.74 78.19 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 119.137 -0.458 . . . . 0.0 112.223 174.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.18 -50.21 74.06 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.643 0.656 . . . . 0.0 111.523 172.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.7 mp -56.39 -34.97 67.23 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.268 1.027 . . . . 0.0 112.149 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 3.3 tpt -65.09 -47.01 78.74 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.039 0.836 . . . . 0.0 111.74 177.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -67.06 -42.35 84.91 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.723 -0.611 . . . . 0.0 111.881 176.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -38.93 93.06 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.129 1.372 . . . . 0.0 112.371 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -63.81 -33.75 76.37 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.625 -1.297 . . . . 0.0 112.117 174.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 81.9 mt -77.04 -36.41 24.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.821 1.248 . . . . 0.0 111.589 175.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.599 ' O ' ' OD1' ' A' ' 141' ' ' ASP . 34.0 t0 -68.57 -30.28 69.02 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 120.869 -1.144 . . . . 0.0 110.365 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -96.99 10.03 40.35 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 173.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? . . . . . 0 N--CA 1.481 1.092 0 O-C-N 120.382 -1.449 . . . . 0.0 113.094 177.371 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.407 ' N ' ' OD2' ' A' ' 92' ' ' ASP . 4.8 t . . . . . 0 CA--C 1.541 0.625 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -62.75 153.45 32.75 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.92 0.888 . . . . 0.0 111.652 173.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.8 p -118.4 159.57 23.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.917 0.865 . . . . 0.0 112.272 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.7 t -118.31 124.8 73.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 C-N-CA 126.446 1.898 . . . . 0.0 107.43 -172.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -79.08 -177.22 5.5 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.116 1.366 . . . . 0.0 110.605 176.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.29 -21.26 5.26 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -174.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.33 52.86 1.27 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.242 1.017 . . . . 0.0 112.333 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.75 -120.24 5.18 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 120.674 -1.266 . . . . 0.0 111.722 -170.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 60.18 171.57 0.09 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.505 1.122 . . . . 0.0 113.42 -173.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.35 111.88 23.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.379 -0.826 . . . . 0.0 109.949 172.366 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.5 mt -79.48 153.46 29.59 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 122.964 1.364 . . . . 0.0 112.769 176.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 18.2 mt -57.62 118.69 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.592 1.157 . . . . 0.0 110.338 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.9 p -146.93 130.39 16.75 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.983 0.913 . . . . 0.0 112.068 177.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -69.65 -14.21 62.7 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 120.868 -1.145 . . . . 0.0 113.223 -176.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.407 ' OD2' ' N ' ' A' ' 78' ' ' SER . 55.6 t0 -76.33 -15.75 59.9 Favored 'General case' 0 N--CA 1.455 -0.197 0 O-C-N 121.14 -0.975 . . . . 0.0 111.985 -177.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.3 -39.51 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.513 0.725 . . . . 0.0 112.4 174.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -64.14 -40.53 96.37 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 120.752 -1.217 . . . . 0.0 112.444 178.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -67.33 -30.4 70.21 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.372 1.069 . . . . 0.0 111.516 178.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -51.93 67.92 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.247 1.019 . . . . 0.0 111.605 172.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -67.34 -39.92 85.82 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.743 -0.646 . . . . 0.0 111.241 179.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.58 -45.46 93.88 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.13 0.972 . . . . 0.0 112.795 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.34 69.29 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -99.62 -14.84 18.8 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.966 0.906 . . . . 0.0 112.702 174.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.4 mt -70.98 -43.86 67.18 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.454 1.102 . . . . 0.0 112.442 171.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.485 1.297 0 CA-C-N 120.553 1.524 . . . . 0.0 112.081 172.861 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.468 0.461 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -67.82 -30.48 69.89 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 173.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.55 -63.92 1.04 Allowed 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.572 1.149 . . . . 0.0 111.751 -174.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -23.79 62.02 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 117.819 -1.086 . . . . 0.0 113.605 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.98 -50.33 66.78 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.519 0.728 . . . . 0.0 111.742 170.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.93 -47.7 84.1 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.895 0.771 . . . . 0.0 111.459 172.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 60.9 mt -56.32 -44.85 80.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.987 0.812 . . . . 0.0 110.836 179.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -76.19 -18.35 59.11 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -86.46 -6.26 58.95 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 173.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.485 ' OE2' ' HA ' ' A' ' 123' ' ' GLU . 27.9 mm-40 -128.49 -37.33 1.81 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -174.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.5 mp -80.69 162.14 24.29 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.137 0.494 . . . . 0.0 110.378 166.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -82.9 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.188 0 CA-C-O 121.921 0.867 . . . . 0.0 113.195 -174.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -164.98 -61.41 0.01 OUTLIER Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.443 1.497 . . . . 0.0 109.528 -178.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.1 -42.95 26.58 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.286 1.324 . . . . 0.0 110.906 173.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.5 -40.74 75.48 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.273 1.029 . . . . 0.0 112.724 177.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -60.76 -41.7 96.0 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.235 1.014 . . . . 0.0 110.568 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -56.58 -39.9 86.31 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 124.421 1.01 . . . . 0.0 113.909 174.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -72.03 -38.44 69.56 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.08 0.94 . . . . 0.0 112.972 171.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.62 -50.17 73.66 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 121.352 1.887 . . . . 0.0 112.578 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.1 pp -66.58 -33.57 75.96 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 176.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.39 -50.81 70.04 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.341 -0.849 . . . . 0.0 112.02 171.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 83.2 mt -58.45 -30.78 67.21 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.441 1.019 . . . . 0.0 111.726 176.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 7.6 ttp -63.62 -64.34 0.92 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.225 1.41 . . . . 0.0 111.963 172.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -64.14 -29.32 70.45 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.872 -1.142 . . . . 0.0 112.44 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.84 -46.62 87.07 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.457 1.903 . . . . 0.0 113.269 171.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . 0.541 ' C ' ' CD1' ' A' ' 139' ' ' TYR . 0.5 OUTLIER -75.88 -22.28 56.32 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 118.145 -1.422 . . . . 0.0 109.873 -177.367 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 69.1 mt -71.58 -45.13 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.023 171.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -58.55 -45.23 89.37 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.482 1.513 . . . . 0.0 110.395 175.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -93.67 15.65 15.78 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.291 1.037 . . . . 0.0 113.588 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? . . . . . 0 N--CA 1.487 1.406 0 O-C-N 120.271 -1.518 . . . . 0.0 111.476 -178.953 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 121.147 0.499 . . . . 0.0 111.59 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -56.27 148.74 17.79 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.299 1.04 . . . . 0.0 112.524 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.6 p -125.32 161.2 27.52 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.716 1.246 . . . . 0.0 113.476 -170.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.5 m -138.46 149.11 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 126.103 1.761 . . . . 0.0 109.838 -175.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -79.5 177.98 8.46 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 124.354 1.061 . . . . 0.0 111.843 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.19 13.1 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 128.32 2.648 . . . . 0.0 116.767 -177.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.8 m -156.92 30.43 0.31 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.661 1.984 . . . . 0.0 111.355 169.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.1 -127.48 8.69 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 120.557 -1.339 . . . . 0.0 112.219 -173.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 57.09 -170.34 0.1 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.426 1.09 . . . . 0.0 112.282 -167.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.35 116.53 26.39 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.438 -0.789 . . . . 0.0 109.823 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mt -88.64 158.02 18.37 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 123.032 1.396 . . . . 0.0 112.884 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 14.2 mt -80.2 95.11 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 124.462 1.105 . . . . 0.0 110.065 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . 0.256 8.1 t -119.45 3.92 11.22 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.006 1.323 . . . . 0.0 113.731 174.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 15.2 ttm105 65.94 -17.75 0.11 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 126.19 1.796 . . . . 0.0 115.42 -177.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -43.01 -47.02 5.71 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.862 1.665 . . . . 0.0 114.814 176.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 48.9 pt -57.18 -27.72 28.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -176.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -70.2 -48.78 55.64 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.158 0.89 . . . . 0.0 110.977 175.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -60.66 -34.4 74.26 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.38 0.672 . . . . 0.0 111.382 173.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 tt -64.09 -49.21 73.16 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.256 1.022 . . . . 0.0 111.864 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -62.8 -44.28 96.58 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.231 0.923 . . . . 0.0 112.711 171.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.11 -42.03 76.18 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.685 1.13 . . . . 0.0 112.308 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.28 -46.25 91.1 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.455 -0.778 . . . . 0.0 112.367 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -78.63 -21.38 48.51 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.7 mt -73.02 -48.33 37.19 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 118.731 0.696 . . . . 0.0 112.145 170.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 13.5 t . . . . . 0 N--CA 1.476 0.835 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -174.091 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 38.1 t70 . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 121.689 0.757 . . . . 0.0 111.544 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.84 -43.01 63.16 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.887 1.275 . . . . 0.0 111.907 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 52.4 tp -57.11 -53.36 58.96 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.459 1.104 . . . . 0.0 111.94 178.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -62.88 -30.13 71.29 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.504 -0.748 . . . . 0.0 112.567 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.94 -40.46 63.06 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.211 1.004 . . . . 0.0 111.617 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.0 -39.39 79.36 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.387 0.675 . . . . 0.0 111.066 175.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 17.0 mt -61.62 -43.32 96.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 O-C-N 121.302 -0.874 . . . . 0.0 111.175 172.284 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.65 -25.17 63.79 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -80.91 -36.87 30.57 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 174.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -93.98 -34.35 13.09 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -175.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 27.5 mt -81.28 170.95 15.43 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.448 1.022 . . . . 0.0 112.41 173.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.96 -78.18 0.2 Allowed 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.693 -0.63 . . . . 0.0 112.101 -167.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -162.05 -63.37 0.02 OUTLIER Pre-proline 0 CA--C 1.543 0.683 0 C-N-CA 125.581 1.553 . . . . 0.0 109.291 174.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -64.52 -37.19 39.39 Favored 'Trans proline' 0 C--N 1.356 0.922 0 CA-C-N 121.156 1.449 . . . . 0.0 111.126 174.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.27 -41.18 62.64 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.403 1.081 . . . . 0.0 112.889 172.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 8.6 ttt180 -63.39 -49.18 74.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.372 1.069 . . . . 0.0 110.587 175.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.71 -31.77 72.3 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.564 1.078 . . . . 0.0 113.894 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -77.22 -32.97 56.25 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.511 1.155 . . . . 0.0 110.95 173.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.22 -46.59 60.85 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.483 -0.761 . . . . 0.0 110.958 -175.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -66.31 -37.96 86.61 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.133 0.573 . . . . 0.0 112.45 174.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.24 -53.58 55.02 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.85 0.75 . . . . 0.0 111.711 176.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 93.0 mt -59.66 -32.51 70.54 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 118.364 -0.827 . . . . 0.0 111.405 177.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 45.9 ttp -66.66 -51.63 53.95 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.558 0.743 . . . . 0.0 112.652 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -65.68 -40.16 92.06 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.302 -0.874 . . . . 0.0 111.763 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -44.4 97.06 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.605 1.162 . . . . 0.0 111.475 174.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -60.18 -47.08 87.46 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.646 -0.659 . . . . 0.0 111.317 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 65.1 mt -59.98 -39.68 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.623 0.769 . . . . 0.0 111.198 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -61.66 -43.23 99.26 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -92.09 6.57 46.0 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? . . . . . 0 N--CA 1.478 0.958 0 C-N-CA 125.262 1.425 . . . . 0.0 112.743 174.12 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 7.9 t-160 . . . . . 0 CA--C 1.55 0.965 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 90.0 mt -137.01 80.25 36.12 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.541 1.536 . . . . 0.0 111.127 176.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -73.22 168.44 24.74 Favored 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.221 3.28 . . . . 0.0 113.209 174.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 80.7 p -88.1 175.82 7.56 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.34 1.456 . . . . 0.0 114.356 -174.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.4 p -60.2 149.06 34.19 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -77.1 -6.02 51.22 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.953 1.464 . . . . 0.0 114.953 -174.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.56 -38.7 0.4 Allowed 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 -169.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 70.04 5.95 54.87 Favored Glycine 0 CA--C 1.54 1.639 0 N-CA-C 116.054 1.182 . . . . 0.0 116.054 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.2 p -63.22 -29.45 70.78 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 119.282 1.541 . . . . 0.0 113.357 178.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.2 t -156.09 -175.64 5.54 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.97 1.708 . . . . 0.0 110.264 -173.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.1 m -105.35 165.51 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.969 1.307 . . . . 0.0 112.109 176.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 -121.34 80.88 1.72 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.707 2.003 . . . . 0.0 108.3 175.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 132.24 76.16 0.12 Allowed Glycine 0 N--CA 1.47 0.95 0 C-N-CA 123.835 0.731 . . . . 0.0 113.526 -179.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.5 ' H ' ' CG ' ' A' ' 92' ' ' ASP . 1.7 t -145.52 20.54 1.51 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.601 2.36 . . . . 0.0 112.081 173.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -59.19 161.88 4.98 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.606 1.963 . . . . 0.0 112.369 172.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.9 p -114.27 165.66 12.45 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.3 1.048 . . . . 0.0 113.648 177.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.2 p -128.83 130.84 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 126.931 2.093 . . . . 0.0 109.961 -172.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -77.99 173.7 11.9 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.519 1.128 . . . . 0.0 111.477 174.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.01 3.96 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 127.617 2.367 . . . . 0.0 116.403 -173.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 15.2 m -152.55 30.41 0.53 Allowed 'General case' 0 N--CA 1.471 0.591 0 O-C-N 119.896 -1.753 . . . . 0.0 112.517 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 92.09 -128.17 9.26 Favored Glycine 0 CA--C 1.528 0.901 0 O-C-N 120.631 -1.293 . . . . 0.0 110.51 -167.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 57.08 172.74 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.821 1.248 . . . . 0.0 112.989 -169.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.3 122.16 43.19 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 120.977 -1.077 . . . . 0.0 109.321 172.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.7 mt -88.37 143.89 26.73 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 120.223 1.374 . . . . 0.0 111.622 173.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.5 mt -63.4 109.82 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.931 1.292 . . . . 0.0 110.037 -176.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.1 p -149.37 143.29 25.67 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.302 1.441 . . . . 0.0 110.847 -173.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 32.5 ttt-85 -71.65 -13.57 61.79 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -175.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.5 ' CG ' ' H ' ' A' ' 78' ' ' SER . 32.4 t70 -51.98 -40.47 60.99 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.699 1.2 . . . . 0.0 112.294 171.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 67.1 mt -54.55 -33.95 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 124.158 0.983 . . . . 0.0 111.572 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 40.1 ttt85 -83.38 -32.4 26.22 Favored 'General case' 0 N--CA 1.456 -0.144 0 O-C-N 120.941 -1.099 . . . . 0.0 111.686 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -61.98 -35.06 77.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.472 -0.142 . . . . 0.0 111.189 170.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.4 -52.84 56.17 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.144 1.378 . . . . 0.0 111.641 177.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -61.74 -46.0 91.53 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.652 -0.655 . . . . 0.0 112.322 172.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -59.77 -41.42 91.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.305 0.957 . . . . 0.0 112.346 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.92 -43.66 98.39 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.695 -0.628 . . . . 0.0 111.608 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -85.66 -12.88 50.19 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.4 mt -73.22 -40.05 65.01 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.635 1.107 . . . . 0.0 111.97 170.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.9 m -78.63 -36.82 43.51 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 171.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -78.58 8.21 5.6 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 173.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 4.2 p -61.78 -32.7 54.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -166.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 74.72 126.49 0.16 Allowed Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.323 0.963 . . . . 0.0 112.886 -174.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.96 -59.81 2.53 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.713 -0.875 . . . . 0.0 111.359 176.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -78.51 -47.68 1.9 Allowed Pre-proline 0 CA--C 1.551 0.991 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 177.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -79.49 16.99 1.31 Allowed 'Trans proline' 0 CA--C 1.547 1.164 0 C-N-CA 123.819 3.013 . . . . 0.0 114.645 -178.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 45.7 tp -41.69 -39.61 1.73 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 127.976 2.51 . . . . 0.0 115.534 -172.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -63.03 -31.02 72.07 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -178.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -82.86 -42.07 18.23 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 118.91 0.777 . . . . 0.0 111.871 -178.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.1 m -58.19 -43.08 87.36 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.173 0.989 . . . . 0.0 112.045 -176.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.1 pp -67.6 -33.32 74.77 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 122.949 0.499 . . . . 0.0 111.959 176.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -72.17 -38.0 69.23 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.346 0.658 . . . . 0.0 111.269 -176.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -70.09 -43.85 70.24 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.207 -0.933 . . . . 0.0 111.929 169.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 54.5 tp -51.13 -61.62 2.12 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.677 0.791 . . . . 0.0 111.44 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.8 ppt_? -60.13 -28.24 67.72 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.847 0.859 . . . . 0.0 112.763 -178.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.76 -41.82 74.67 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 173.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -59.79 -47.84 84.08 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.096 0.862 . . . . 0.0 112.163 176.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.1 mp -60.1 -42.66 90.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 118.517 0.599 . . . . 0.0 111.088 176.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.54 -23.49 65.44 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.42 -50.55 5.89 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.71 0.804 . . . . 0.0 112.735 174.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -76.94 -38.48 53.27 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.416 -1.427 . . . . 0.0 113.206 -170.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.475 HD12 ' HB1' ' A' ' 128' ' ' ALA . 3.3 mm? -68.66 -172.33 0.35 Allowed 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 120.199 1.363 . . . . 0.0 111.567 171.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -97.5 -120.34 0.13 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.632 1.173 . . . . 0.0 110.109 169.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.484 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 20.5 tt0 -120.26 -63.86 0.03 OUTLIER Pre-proline 0 CA--C 1.536 0.423 0 C-N-CA 125.699 1.6 . . . . 0.0 108.448 -172.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.484 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.9 Cg_endo -67.22 -36.3 21.76 Favored 'Trans proline' 0 C--N 1.351 0.675 0 CA-C-N 120.641 1.265 . . . . 0.0 111.307 174.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.475 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -59.74 -34.25 72.71 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 120.833 -1.167 . . . . 0.0 112.477 176.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 19.0 ttt180 -63.09 -48.77 77.17 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.279 1.031 . . . . 0.0 110.434 172.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.14 -34.57 80.21 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 124.729 1.157 . . . . 0.0 113.514 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -75.25 -33.04 61.26 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 118.38 1.09 . . . . 0.0 111.171 174.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.03 -44.93 62.61 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.212 0.605 . . . . 0.0 111.132 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.35 -37.05 80.12 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.252 0.621 . . . . 0.0 112.365 174.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.22 -55.49 24.54 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 118.387 0.54 . . . . 0.0 111.696 175.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.8 mp -56.9 -30.47 63.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.2 175.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 9.3 tmm? -67.34 -52.05 44.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.215 0.916 . . . . 0.0 111.673 176.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -67.37 -38.33 84.6 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.45 -0.781 . . . . 0.0 112.583 177.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.11 -34.96 73.77 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.529 1.532 . . . . 0.0 112.224 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -63.13 -46.94 84.9 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.115 -0.99 . . . . 0.0 110.3 168.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 78.2 mt -60.58 -34.94 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.588 0.755 . . . . 0.0 112.269 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.468 ' O ' ' OD1' ' A' ' 141' ' ' ASP . 48.4 t0 -67.37 -25.3 65.9 Favored 'General case' 0 C--N 1.34 0.177 0 C-N-CA 124.101 0.96 . . . . 0.0 111.63 -177.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -113.21 5.81 17.16 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 175.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? -74.64 -25.9 59.52 Favored 'General case' 0 N--CA 1.479 1.022 0 O-C-N 120.675 -1.265 . . . . 0.0 112.94 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -88.02 135.39 33.44 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 126.527 1.931 . . . . 0.0 110.829 174.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -79.31 43.67 0.55 Allowed 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 -178.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 CA--C 1.549 0.907 0 C-N-CA 125.79 1.636 . . . . 0.0 113.489 171.956 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 . . . . . 0 CA--C 1.549 0.929 0 CA-C-O 121.622 0.725 . . . . 0.0 112.132 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 73.9 mt -64.21 149.2 94.7 Favored Pre-proline 0 CA--C 1.543 0.71 0 C-N-CA 124.556 1.143 . . . . 0.0 111.696 175.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -63.61 148.97 92.03 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 122.685 2.257 . . . . 0.0 112.658 176.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.0 p -77.81 -176.4 4.4 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.501 1.92 . . . . 0.0 113.44 -174.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.3 p -74.33 -163.73 0.21 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.643 0.777 . . . . 0.0 111.853 164.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -59.8 160.19 7.88 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 125.754 1.621 . . . . 0.0 113.902 -176.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 6.4 mtp180 -63.54 130.07 42.83 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 121.129 -0.982 . . . . 0.0 111.832 178.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 129.99 -150.43 19.09 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.61 1.1 . . . . 0.0 111.506 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.9 t -73.27 -178.52 2.97 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.398 0.679 . . . . 0.0 111.861 171.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 50.8 m -63.78 166.66 6.86 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.99 1.316 . . . . 0.0 113.429 177.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.3 m -56.09 134.07 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.77 0.828 . . . . 0.0 111.205 175.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -82.92 50.65 1.76 Allowed 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -168.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.24 119.76 16.28 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 123.744 0.687 . . . . 0.0 112.989 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.47 ' H ' ' CG ' ' A' ' 92' ' ' ASP . 2.9 t -142.81 28.16 1.6 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.693 1.997 . . . . 0.0 112.045 -175.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -68.8 165.75 19.04 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.44 -1.413 . . . . 0.0 111.043 165.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.5 p -134.43 160.33 38.33 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.729 0.776 . . . . 0.0 112.335 175.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 21.4 t -122.76 128.13 75.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 125.927 1.691 . . . . 0.0 108.193 -169.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -81.84 177.1 9.07 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.561 1.144 . . . . 0.0 112.726 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.93 -19.15 1.63 Allowed 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -170.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.5 m -134.69 29.93 3.48 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.039 1.336 . . . . 0.0 112.434 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 96.21 -123.12 7.59 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -171.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 50.1 m-20 59.22 178.62 0.08 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.66 1.184 . . . . 0.0 114.067 -176.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.12 127.37 54.11 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.369 -0.832 . . . . 0.0 109.114 168.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.8 mt -93.22 149.75 21.0 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 122.117 0.961 . . . . 0.0 110.957 168.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 16.7 mt -79.75 99.74 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 O-C-N 121.447 -0.783 . . . . 0.0 110.625 -173.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 30.1 p -118.28 -1.48 11.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.254 1.022 . . . . 0.0 113.398 170.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 64.95 -0.31 1.05 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.152 1.781 . . . . 0.0 115.389 -175.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.47 ' CG ' ' H ' ' A' ' 78' ' ' SER . 29.5 t70 -50.06 -49.5 51.05 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.843 1.657 . . . . 0.0 114.718 178.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.2 pt -52.6 -25.86 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.684 0 N-CA-C 113.72 1.008 . . . . 0.0 113.72 -176.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -61.66 -45.59 93.36 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.672 1.124 . . . . 0.0 112.145 171.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -58.29 -40.71 82.67 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.054 0.843 . . . . 0.0 111.637 173.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.47 -39.65 85.29 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.554 0.742 . . . . 0.0 111.983 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -70.88 -43.63 67.99 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.092 0.86 . . . . 0.0 112.603 171.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -59.14 -36.84 75.96 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.4 1.08 . . . . 0.0 112.234 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.89 -24.17 67.45 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 175.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -111.04 -11.78 14.26 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.429 1.092 . . . . 0.0 113.641 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.4 mt -75.93 -33.82 59.87 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.302 1.041 . . . . 0.0 111.008 167.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.4 p -74.97 -42.15 58.17 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.553 1.141 . . . . 0.0 112.13 170.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -90.84 26.22 2.14 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.199 1.4 . . . . 0.0 114.233 176.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 8.7 p -56.81 -29.35 30.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -165.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 133.89 119.75 2.02 Favored Glycine 0 N--CA 1.468 0.785 0 O-C-N 121.185 -0.947 . . . . 0.0 113.077 169.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -69.34 -33.62 73.39 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 114.109 1.151 . . . . 0.0 114.109 -178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.468 ' H ' ' HD2' ' A' ' 108' ' ' PRO . 43.6 mt-10 -146.32 -54.44 0.02 OUTLIER Pre-proline 0 N--CA 1.478 0.974 0 C-N-CA 126.164 1.785 . . . . 0.0 112.722 179.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.468 ' HD2' ' H ' ' A' ' 107' ' ' GLU . 66.7 Cg_endo -79.65 58.6 7.04 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 123.644 2.896 . . . . 0.0 112.821 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.39 -42.02 61.11 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.43 1.492 . . . . 0.0 112.12 -177.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 67.3 mm-40 -60.83 -20.59 61.98 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.742 1.217 . . . . 0.0 113.71 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -96.08 -24.39 16.34 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.609 1.164 . . . . 0.0 113.353 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.1 m -61.27 -49.32 77.53 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.538 -1.351 . . . . 0.0 110.43 167.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.3 pp -68.39 -31.15 70.3 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 118.355 -0.831 . . . . 0.0 112.761 -177.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.2 -49.27 78.31 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.407 0.683 . . . . 0.0 110.939 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 85.2 mtm180 -65.37 -46.62 79.42 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.475 1.11 . . . . 0.0 111.007 176.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.1 tt -51.05 -64.01 0.95 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.626 1.17 . . . . 0.0 111.4 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -32.48 68.54 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.561 1.144 . . . . 0.0 112.809 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.87 87.38 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.904 -0.569 . . . . 0.0 112.127 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -60.79 -47.85 84.45 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.781 0.719 . . . . 0.0 112.116 176.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.3 mp -63.15 -45.03 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.155 0.889 . . . . 0.0 111.348 176.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.79 -29.74 69.01 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -179.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.67 -65.83 0.74 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.812 0.845 . . . . 0.0 110.899 172.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -70.72 -46.08 63.73 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.304 1.441 . . . . 0.0 113.403 -169.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 6.8 mp -78.58 164.13 24.93 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 120.727 -1.233 . . . . 0.0 109.809 168.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -79.09 -93.47 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.499 0.72 . . . . 0.0 112.329 -165.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.465 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 47.0 tt0 -146.92 -54.6 0.02 OUTLIER Pre-proline 0 CA--C 1.542 0.665 0 C-N-CA 124.962 1.305 . . . . 0.0 111.198 175.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.465 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 64.2 Cg_endo -70.84 -38.89 4.91 Favored 'Trans proline' 0 C--N 1.354 0.84 0 CA-C-N 121.449 1.553 . . . . 0.0 111.004 171.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.69 -42.08 64.46 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.221 1.408 . . . . 0.0 112.678 177.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -56.36 -49.29 74.82 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.766 2.026 . . . . 0.0 111.19 173.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.22 -34.38 67.13 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 125.151 1.357 . . . . 0.0 113.798 176.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -76.79 -31.19 56.83 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.457 1.128 . . . . 0.0 110.92 175.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.2 -50.98 50.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 122.87 0.468 . . . . 0.0 110.36 -178.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.7 pp -66.34 -35.77 81.21 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 177.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.65 -53.11 56.51 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.603 0.638 . . . . 0.0 112.019 174.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.67 -27.57 68.78 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 117.655 -1.164 . . . . 0.0 111.692 175.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -64.93 -53.09 51.86 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.866 1.212 . . . . 0.0 111.677 173.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -64.31 -41.45 96.84 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 177.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -68.41 -40.39 81.28 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.011 1.324 . . . . 0.0 112.671 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -58.19 -38.51 76.87 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.201 -0.937 . . . . 0.0 111.157 169.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 86.4 mt -71.23 -44.43 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 123.712 0.805 . . . . 0.0 112.387 177.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -54.44 -31.43 55.39 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.608 1.563 . . . . 0.0 111.466 174.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -106.34 3.93 28.06 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 178.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -72.44 -25.72 61.56 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 125.022 1.329 . . . . 0.0 112.875 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -98.75 135.92 39.53 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.969 0.908 . . . . 0.0 109.995 -177.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 24.0 pt-20 -72.59 28.13 0.06 Allowed 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.846 1.658 . . . . 0.0 114.553 178.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 50.1 mt . . . . . 0 CA--C 1.545 0.773 0 C-N-CA 130.115 3.366 . . . . 0.0 117.032 -177.266 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 9.7 m170 . . . . . 0 N--CA 1.468 0.464 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.9 tp 46.87 62.14 12.25 Favored Pre-proline 0 CA--C 1.558 1.277 0 C-N-CA 125.876 1.67 . . . . 0.0 113.786 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -62.79 130.88 30.92 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 122.583 2.189 . . . . 0.0 111.292 -178.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.2 p -141.27 107.02 5.11 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.433 1.493 . . . . 0.0 110.554 -163.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 59.0 p -135.7 39.95 2.79 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -169.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 30.3 p90 -68.82 22.0 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 128.037 2.535 . . . . 0.0 116.38 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -70.77 170.35 12.64 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.575 1.55 . . . . 0.0 113.591 179.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 121.02 -177.5 16.38 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 125.476 1.513 . . . . 0.0 112.159 -174.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.5 t -68.37 148.43 50.71 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 122.149 -0.618 . . . . 0.0 110.619 166.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.4 t 57.27 62.88 2.04 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 -177.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 8.7 m -57.8 163.55 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.294 1.038 . . . . 0.0 112.561 171.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -30.93 -63.22 0.15 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.473 1.909 . . . . 0.0 115.723 178.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 117.16 140.55 6.7 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 122.939 1.3 . . . . 0.0 112.611 -173.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.9 t -78.95 92.11 4.9 Favored 'General case' 0 C--O 1.238 0.487 0 O-C-N 121.613 -0.934 . . . . 0.0 109.701 173.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -53.48 154.96 3.18 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.435 1.112 . . . . 0.0 111.711 175.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 5.9 p -114.2 157.88 22.09 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.204 1.402 . . . . 0.0 111.722 -175.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.5 t -129.48 128.23 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 125.505 1.522 . . . . 0.0 107.478 -172.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -81.54 -175.17 5.38 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.736 0.814 . . . . 0.0 111.293 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.39 -21.0 8.44 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -172.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -144.73 50.79 1.26 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.291 1.036 . . . . 0.0 112.334 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.07 -122.82 5.84 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 120.376 -1.452 . . . . 0.0 110.826 -169.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 60.31 172.0 0.09 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.338 1.055 . . . . 0.0 112.964 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.59 119.14 38.65 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 170.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.62 143.52 38.17 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-O 121.568 0.699 . . . . 0.0 110.12 173.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 48.0 mm -73.23 108.33 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 O-C-N 121.56 -0.712 . . . . 0.0 109.932 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.2 p -152.32 158.24 42.47 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.991 1.316 . . . . 0.0 112.392 177.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -57.93 -14.23 5.9 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.488 1.515 . . . . 0.0 114.494 -174.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -66.15 -28.79 69.06 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 122.47 0.308 . . . . 0.0 111.7 -178.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.542 HG21 HD23 ' A' ' 135' ' ' LEU . 88.1 mt -62.51 -53.99 39.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 121.285 0.564 . . . . 0.0 111.662 178.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -72.28 -28.75 63.31 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 118.587 -0.72 . . . . 0.0 112.818 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.48 -40.11 73.81 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.75 174.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.07 -51.25 58.78 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.819 1.247 . . . . 0.0 111.606 170.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -66.0 -36.12 82.42 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.034 -1.041 . . . . 0.0 112.056 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.57 -48.13 80.81 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.982 1.264 . . . . 0.0 111.306 173.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.44 -35.32 75.54 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.99 0.916 . . . . 0.0 112.644 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -91.04 -17.09 26.83 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.9 mt -72.98 -34.95 66.77 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 120.605 -1.31 . . . . 0.0 113.019 175.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.6 t -82.22 -5.21 58.34 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.339 0.972 . . . . 0.0 113.096 175.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -83.13 -2.55 55.73 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 124.762 1.225 . . . . 0.0 114.242 173.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 3.8 p -88.63 -5.61 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -175.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -73.76 -7.26 74.49 Favored Glycine 0 CA--C 1.541 1.691 0 O-C-N 120.182 -1.573 . . . . 0.0 113.979 175.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -115.97 -60.17 1.9 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.177 1.791 . . . . 0.0 112.197 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.422 ' OE2' ' NH1' ' A' ' 115' ' ' ARG . 13.4 mt-10 -93.96 151.51 39.82 Favored Pre-proline 0 CA--C 1.542 0.655 0 N-CA-C 113.734 1.012 . . . . 0.0 113.734 -179.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -68.86 150.63 73.74 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.764 2.309 . . . . 0.0 111.236 173.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -51.45 -37.54 49.29 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-N 115.11 -0.95 . . . . 0.0 113.293 -179.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -45.88 81.16 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 117.63 -1.176 . . . . 0.0 112.472 177.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -80.36 -37.94 31.43 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 120.358 1.436 . . . . 0.0 113.435 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 27.0 p -63.9 -40.53 96.73 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.221 0.919 . . . . 0.0 111.575 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.45 -36.72 76.88 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-O 117.783 -1.103 . . . . 0.0 111.962 173.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -55.67 -42.22 74.81 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.33 0.968 . . . . 0.0 110.524 -174.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.422 ' NH1' ' OE2' ' A' ' 107' ' ' GLU . 82.0 mtt180 -78.03 -41.29 36.17 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.767 0.827 . . . . 0.0 111.167 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 33.2 tp -55.99 -59.77 4.43 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.966 0.412 . . . . 0.0 111.994 177.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -24.83 64.44 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.349 -0.834 . . . . 0.0 113.002 -178.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.48 -51.27 53.34 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.864 0.756 . . . . 0.0 111.842 170.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -51.06 69.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.551 0.74 . . . . 0.0 110.812 173.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 62.1 mt -55.45 -43.7 73.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 O-C-N 121.7 -0.625 . . . . 0.0 111.461 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -77.8 -24.66 48.75 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -75.73 -42.54 50.41 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.606 0.763 . . . . 0.0 110.056 172.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -76.74 -61.13 2.07 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 124.598 1.159 . . . . 0.0 112.9 -178.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 57.5 mt -60.38 171.9 0.97 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.926 1.239 . . . . 0.0 112.221 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 10.8 tp-100 -71.48 -88.99 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.857 0.863 . . . . 0.0 111.936 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -166.13 -59.19 0.01 OUTLIER Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 125.645 1.578 . . . . 0.0 109.432 -172.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -63.2 -44.49 15.04 Favored 'Trans proline' 0 C--N 1.359 1.104 0 CA-C-N 120.357 1.163 . . . . 0.0 110.748 171.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.27 -37.54 75.17 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.435 1.094 . . . . 0.0 112.772 177.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 14.1 ttt180 -58.24 -47.24 84.15 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.484 0.714 . . . . 0.0 110.671 174.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -54.08 -45.47 72.45 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.299 0.952 . . . . 0.0 112.793 176.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.08 -37.19 83.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.01 0.905 . . . . 0.0 113.16 174.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -67.42 -50.01 61.26 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 120.627 1.558 . . . . 0.0 112.324 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.0 pp -65.45 -34.82 79.19 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.732 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.35 -48.38 75.75 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-O 119.054 -0.498 . . . . 0.0 111.301 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.542 HD23 HG21 ' A' ' 93' ' ' ILE . 6.0 mp -61.01 -28.07 68.77 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 117.349 -1.31 . . . . 0.0 111.471 175.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.39 -58.47 6.97 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 120.154 1.343 . . . . 0.0 111.851 172.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -66.75 -37.14 84.05 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.276 -0.89 . . . . 0.0 112.48 178.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.21 -45.02 90.1 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 125.154 1.382 . . . . 0.0 112.102 174.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -59.3 -42.26 90.93 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 118.876 -0.583 . . . . 0.0 110.609 171.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 49.2 mt -61.99 -33.61 59.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-O 118.091 -0.957 . . . . 0.0 112.17 175.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -62.87 -44.04 97.18 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.398 0.999 . . . . 0.0 112.466 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -100.21 14.2 31.65 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 174.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 23.2 ttpt -66.09 -40.4 90.79 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 120.639 -1.288 . . . . 0.0 112.865 -175.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -72.73 -177.0 2.16 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.072 0.949 . . . . 0.0 108.882 171.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 58.19 28.8 17.04 Favored 'General case' 0 CA--C 1.552 1.045 0 O-C-N 120.604 -1.31 . . . . 0.0 114.298 175.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 9.6 mt . . . . . 0 CA--C 1.55 0.957 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 174.442 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 63.4 m170 . . . . . 0 CA--C 1.555 1.155 0 N-CA-C 115.422 1.638 . . . . 0.0 115.422 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 11.2 mp 69.1 152.48 0.13 Allowed Pre-proline 0 CA--C 1.553 1.077 0 C-N-CA 129.269 3.028 . . . . 0.0 114.437 -168.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -79.9 -22.62 7.37 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.286 2.657 . . . . 0.0 115.126 -170.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.5 p -121.68 155.96 34.06 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.139 1.375 . . . . 0.0 111.097 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.0 t -104.19 127.86 51.85 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.552 -0.718 . . . . 0.0 112.147 -176.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 43.2 p90 -85.92 20.58 2.18 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.635 1.974 . . . . 0.0 113.335 -177.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 44.6 ttp180 61.34 -27.38 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 128.861 2.864 . . . . 0.0 116.596 -177.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -73.67 72.71 1.24 Allowed Glycine 0 CA--C 1.531 1.05 0 C-N-CA 125.613 1.578 . . . . 0.0 114.261 -178.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.5 t -56.56 -23.71 42.13 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -176.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.9 t -157.35 163.51 38.55 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.238 1.415 . . . . 0.0 110.961 165.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 10.0 p -90.24 159.04 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 125.58 1.552 . . . . 0.0 111.934 178.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -134.59 29.23 3.57 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.698 -0.627 . . . . 0.0 112.128 -169.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -77.06 129.55 9.77 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 124.892 1.234 . . . . 0.0 114.389 179.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.0 t -126.54 24.44 6.67 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.643 1.977 . . . . 0.0 112.236 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -62.07 154.31 27.29 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.824 1.25 . . . . 0.0 114.262 -168.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.563 ' H ' HG21 ' A' ' 90' ' ' THR . 35.8 p -92.24 152.92 19.59 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.067 1.347 . . . . 0.0 112.956 177.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.3 t -122.89 137.27 56.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 126.052 1.741 . . . . 0.0 107.926 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.407 ' HB3' HD22 ' A' ' 86' ' ' ASN . 15.5 t0 -75.8 175.64 8.53 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.428 1.091 . . . . 0.0 111.794 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.7 -12.38 1.83 Allowed 'General case' 0 CA--C 1.553 1.09 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 -174.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 69.8 m -155.63 64.53 0.6 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.773 1.629 . . . . 0.0 110.536 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 73.6 -123.96 8.48 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 121.709 -0.619 . . . . 0.0 111.97 -174.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.407 HD22 ' HB3' ' A' ' 82' ' ' ASP . 6.7 m-80 55.31 -179.51 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.864 1.265 . . . . 0.0 112.733 -172.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -115.3 127.23 55.31 Favored 'General case' 0 N--CA 1.481 1.116 0 O-C-N 120.291 -1.506 . . . . 0.0 110.747 171.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.8 mt -96.23 154.66 17.13 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 122.709 1.243 . . . . 0.0 112.863 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 32.6 mm -78.48 93.57 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 124.555 1.142 . . . . 0.0 111.235 -175.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.563 HG21 ' H ' ' A' ' 80' ' ' SER 0.255 13.7 t -132.15 12.96 4.69 Favored 'General case' 0 N--CA 1.484 1.273 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -179.29 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 66.82 -19.27 0.11 Allowed 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 116.671 2.1 . . . . 0.0 116.671 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -42.62 -51.22 5.27 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 126.385 1.874 . . . . 0.0 114.828 178.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 21.6 pt -55.51 -31.29 27.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 94' ' ' ARG . 2.7 mtp85 -67.02 -43.77 81.98 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.164 -0.96 . . . . 0.0 111.527 175.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -69.51 -19.67 63.72 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.699 1.6 . . . . 0.0 112.919 176.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.86 -56.94 4.15 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.087 1.355 . . . . 0.0 111.246 167.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -59.82 -41.5 91.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 119.095 0.861 . . . . 0.0 112.89 -178.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -64.96 -37.68 88.46 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.875 0.761 . . . . 0.0 111.953 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.08 -30.44 70.35 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.415 0.895 . . . . 0.0 113.415 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -89.12 -38.23 14.48 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.793 0.837 . . . . 0.0 113.043 173.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.2 mt -59.02 -45.25 91.16 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.342 0.974 . . . . 0.0 111.041 176.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.3 m -74.35 5.64 4.39 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.105 1.362 . . . . 0.0 114.307 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -121.73 4.52 10.04 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.753 1.621 . . . . 0.0 115.005 -177.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 10.4 p -68.58 -36.72 75.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 114.873 1.435 . . . . 0.0 114.873 -170.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 52.29 -147.6 12.98 Favored Glycine 0 CA--C 1.544 1.882 0 N-CA-C 115.711 1.044 . . . . 0.0 115.711 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -96.39 8.98 42.66 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 122.43 -0.453 . . . . 0.0 110.807 175.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -70.61 153.98 94.64 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 123.562 0.745 . . . . 0.0 111.818 174.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -68.49 120.91 7.83 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.63 2.22 . . . . 0.0 111.172 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.0 mt -49.38 -32.08 10.77 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.901 1.28 . . . . 0.0 112.922 177.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -53.5 -37.45 62.76 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.79 1.636 . . . . 0.0 112.831 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -89.9 -37.15 14.61 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 -179.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 47.7 t -55.56 -50.23 70.59 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.345 0.658 . . . . 0.0 110.992 172.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.2 pp -67.51 -34.1 76.42 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.465 -0.778 . . . . 0.0 112.962 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.0 -42.9 99.97 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.973 0.806 . . . . 0.0 111.697 -174.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 70.1 mtt-85 -70.03 -44.94 68.22 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.665 -0.647 . . . . 0.0 111.81 171.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.2 tt -50.08 -61.55 2.09 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.231 1.013 . . . . 0.0 111.533 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.97 -27.51 68.33 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.514 -1.366 . . . . 0.0 113.387 179.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -70.69 -43.5 68.9 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 124.127 0.892 . . . . 0.0 111.566 177.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -53.98 -52.39 60.87 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.641 0.776 . . . . 0.0 111.545 176.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.18 -42.71 91.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 O-C-N 121.371 -0.831 . . . . 0.0 111.922 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.41 ' HB2' ' CZ ' ' A' ' 129' ' ' ARG . . . -70.28 -31.03 68.21 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.029 -1.045 . . . . 0.0 113.596 -178.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.08 -63.97 0.95 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.417 0.687 . . . . 0.0 110.483 169.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -62.06 -50.44 71.96 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.19 2.196 . . . . 0.0 113.929 -171.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.441 HD12 ' HB1' ' A' ' 128' ' ' ALA . 2.6 mm? -78.59 164.47 24.64 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 122.276 1.036 . . . . 0.0 110.328 176.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -77.2 -94.13 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.183 0.993 . . . . 0.0 111.447 -169.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.519 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 37.6 tt0 -140.79 -58.68 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 124.646 1.178 . . . . 0.0 110.454 167.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.519 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.2 Cg_endo -66.88 -35.75 25.68 Favored 'Trans proline' 0 C--N 1.352 0.739 0 CA-C-N 122.036 1.763 . . . . 0.0 111.484 176.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.441 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -57.98 -32.01 67.46 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 120.98 -1.075 . . . . 0.0 112.779 173.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.41 ' CZ ' ' HB2' ' A' ' 121' ' ' ALA . 0.0 OUTLIER -64.14 -48.77 74.73 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.063 1.345 . . . . 0.0 109.903 173.499 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.19 -34.32 87.63 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 126.415 1.959 . . . . 0.0 114.49 176.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -74.98 -30.71 61.26 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.777 1.288 . . . . 0.0 110.475 173.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.86 58.42 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 122.909 0.484 . . . . 0.0 110.357 -176.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -66.51 -39.76 88.85 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 118.914 -0.565 . . . . 0.0 111.841 173.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.42 -54.54 44.3 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.37 0.986 . . . . 0.0 111.913 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 9.2 mp -64.45 -25.96 68.23 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.698 176.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 59.7 ttp -65.78 -53.02 45.96 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 120.056 1.298 . . . . 0.0 111.831 172.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . 0.506 ' HA ' HE21 ' A' ' 137' ' ' GLN . 0.0 OUTLIER -66.92 -43.15 84.03 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.122 0.874 . . . . 0.0 111.619 178.344 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -28.16 68.29 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.412 1.085 . . . . 0.0 112.846 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -68.0 -47.74 67.68 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.468 -1.395 . . . . 0.0 111.186 167.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 85.8 mt -62.27 -38.58 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.387 1.075 . . . . 0.0 112.561 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -52.98 -32.92 48.85 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.215 1.806 . . . . 0.0 113.09 173.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -112.85 2.69 16.02 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.405 1.482 . . . . 0.0 114.02 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -72.39 -19.16 61.65 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.932 1.693 . . . . 0.0 112.681 175.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -88.92 136.96 32.73 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.477 1.111 . . . . 0.0 110.109 174.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -77.51 42.76 0.37 Allowed 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 124.944 1.298 . . . . 0.0 113.687 177.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 48.0 mt . . . . . 0 CA--C 1.547 0.843 0 C-N-CA 131.18 3.792 . . . . 0.0 117.018 -178.747 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 50.6 m170 . . . . . 0 CA--C 1.553 1.058 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 41.8 tp -128.09 73.67 79.37 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 126.373 1.869 . . . . 0.0 110.435 179.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -63.72 140.3 73.58 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.087 1.858 . . . . 0.0 110.453 171.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 75.1 p -104.57 152.62 22.2 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.739 0.816 . . . . 0.0 112.765 -170.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.4 t -159.04 128.88 5.66 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 123.793 0.837 . . . . 0.0 110.693 176.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 41.2 p90 -163.51 154.66 16.58 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.642 1.577 . . . . 0.0 111.372 178.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.3 mtt85 -172.5 143.18 1.34 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 126.428 1.891 . . . . 0.0 109.771 172.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -169.99 51.34 0.2 Allowed Glycine 0 CA--C 1.529 0.965 0 CA-C-O 119.33 -0.706 . . . . 0.0 114.566 -175.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . 0.257 21.0 p 55.21 -3.67 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 128.34 2.656 . . . . 0.0 117.841 177.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 62.1 m -120.63 -167.25 1.44 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 128.019 2.528 . . . . 0.0 111.041 173.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 14.4 p -142.68 144.89 23.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.883 1.273 . . . . 0.0 111.786 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -84.6 91.09 7.81 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 123.049 1.404 . . . . 0.0 108.884 171.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -54.78 -157.14 0.01 OUTLIER Glycine 0 CA--C 1.549 2.171 0 N-CA-C 116.719 1.447 . . . . 0.0 116.719 169.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.8 t -129.89 116.48 18.72 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.534 1.534 . . . . 0.0 110.0 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -78.1 178.98 7.12 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 128.041 2.536 . . . . 0.0 113.157 -174.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 32.5 p -115.35 161.67 18.19 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.771 1.229 . . . . 0.0 113.921 176.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.1 t -135.7 133.42 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 126.174 1.79 . . . . 0.0 109.541 -171.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -88.98 178.25 6.45 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.722 1.209 . . . . 0.0 112.961 177.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.53 -1.64 0.16 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 127.928 2.491 . . . . 0.0 117.718 -167.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 31.0 t -152.56 35.94 0.51 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.398 1.479 . . . . 0.0 111.372 173.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 87.47 -123.15 6.48 Favored Glycine 0 CA--C 1.529 0.912 0 O-C-N 120.934 -1.104 . . . . 0.0 110.649 -167.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 59.39 175.92 0.08 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.951 0.9 . . . . 0.0 111.665 -163.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.9 132.48 52.8 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 117.788 -1.101 . . . . 0.0 108.901 165.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.3 mt -98.69 150.51 21.72 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.916 1.235 . . . . 0.0 112.316 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 24.5 mt -63.62 111.81 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 125.144 1.378 . . . . 0.0 110.628 -173.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -142.74 154.38 44.22 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.76 1.224 . . . . 0.0 112.291 -173.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -101.03 -10.54 20.43 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -164.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -64.69 -29.48 70.47 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.892 0.877 . . . . 0.0 111.66 168.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 64.5 mt -49.77 -40.38 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 125.778 1.631 . . . . 0.0 112.103 175.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.18 -53.19 58.84 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 121.417 -0.802 . . . . 0.0 110.978 173.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -61.45 -30.0 70.31 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.823 0.849 . . . . 0.0 111.997 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.88 -53.52 52.84 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.984 1.714 . . . . 0.0 111.746 173.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -60.94 -43.55 98.51 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.32 -0.848 . . . . 0.0 112.416 173.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.47 -40.65 87.64 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.179 1.354 . . . . 0.0 112.636 177.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.88 -20.78 66.61 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -112.39 -21.74 11.22 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.365 1.066 . . . . 0.0 113.656 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.12 -48.94 74.12 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 118.998 0.817 . . . . 0.0 110.079 169.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 11.3 m -68.73 -18.57 64.25 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.809 0.843 . . . . 0.0 113.137 179.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -81.86 -7.53 59.61 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -176.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 8.9 p -69.56 -40.82 80.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -169.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 53.82 -128.82 40.81 Favored Glycine 0 CA--C 1.538 1.509 0 O-C-N 121.602 -0.686 . . . . 0.0 112.75 -171.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -87.87 -12.23 45.46 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.748 1.219 . . . . 0.0 113.573 176.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -75.65 147.56 81.68 Favored Pre-proline 0 CA--C 1.546 0.789 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -164.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -63.97 139.01 65.5 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 122.351 2.034 . . . . 0.0 111.432 177.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 18.1 mt -52.09 -26.91 12.24 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 -173.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -46.24 -43.22 15.3 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.93 1.292 . . . . 0.0 113.477 176.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -80.69 -39.6 26.87 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 120.318 1.417 . . . . 0.0 113.329 -176.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 38.6 t -64.94 -44.12 90.48 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 121.546 -0.721 . . . . 0.0 110.941 176.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.1 pp -68.45 -29.27 67.88 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 118.127 -0.939 . . . . 0.0 112.576 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -62.21 -58.43 7.77 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.041 0.837 . . . . 0.0 110.809 174.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.4 mtt85 -59.97 -40.61 89.69 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.071 -1.018 . . . . 0.0 112.263 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 50.5 tp -62.12 -57.35 11.88 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.795 0.838 . . . . 0.0 112.496 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.6 ptm85 -60.91 -33.8 73.7 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 121.677 -0.639 . . . . 0.0 111.589 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.66 -44.02 87.58 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 124.198 0.936 . . . . 0.0 111.421 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.74 -42.7 81.42 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.477 0.711 . . . . 0.0 110.741 176.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 18.0 mt -61.09 -42.44 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.259 -0.901 . . . . 0.0 111.208 176.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.38 -22.2 61.91 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -84.64 -31.62 24.1 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 171.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -99.73 -34.77 10.04 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 115.324 1.601 . . . . 0.0 115.324 -173.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 60.2 mt -81.72 174.32 11.47 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.394 0.997 . . . . 0.0 111.611 167.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.34 -97.56 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.93 0.892 . . . . 0.0 111.525 -176.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.445 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 49.3 tt0 -145.43 -57.54 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.629 0 O-C-N 120.964 -1.085 . . . . 0.0 110.293 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.445 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 73.7 Cg_endo -69.76 -37.94 8.49 Favored 'Trans proline' 0 C--N 1.355 0.897 0 CA-C-N 121.581 1.6 . . . . 0.0 112.133 173.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.73 -39.85 68.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.699 1.2 . . . . 0.0 112.157 176.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -58.17 -46.81 85.09 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.128 1.371 . . . . 0.0 110.74 174.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -56.3 -34.37 62.97 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 125.363 1.459 . . . . 0.0 113.621 175.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -77.61 -30.6 52.46 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 118.622 1.211 . . . . 0.0 111.494 175.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.36 -45.4 60.03 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.541 -0.725 . . . . 0.0 111.291 -178.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.79 -34.11 75.0 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.611 -0.709 . . . . 0.0 112.371 173.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.87 -53.58 56.18 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 119.144 0.884 . . . . 0.0 111.614 173.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 72.6 mt -55.41 -37.16 67.26 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.05 0.54 . . . . 0.0 111.328 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -52.51 46.56 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.051 0.94 . . . . 0.0 111.933 177.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -64.68 -38.94 92.71 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.735 -1.228 . . . . 0.0 112.834 178.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -43.76 98.19 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.837 1.255 . . . . 0.0 111.165 172.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -60.51 -39.87 89.32 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.533 -0.73 . . . . 0.0 111.566 172.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 59.7 mt -67.13 -35.21 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 119.934 1.243 . . . . 0.0 112.359 177.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -58.02 -49.78 75.68 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.492 0.717 . . . . 0.0 110.32 170.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -93.08 -0.53 57.05 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -173.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -65.35 -36.43 84.0 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.437 1.095 . . . . 0.0 112.646 -178.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 5.7 ptpp? -100.31 177.26 5.1 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.957 0.903 . . . . 0.0 110.902 169.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 57.64 33.17 22.91 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 6.2 mp . . . . . 0 CA--C 1.548 0.892 0 C-N-CA 127.002 2.121 . . . . 0.0 114.683 170.09 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 80.1 m80 . . . . . 0 CA--C 1.539 0.536 0 CA-C-O 120.914 0.388 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.7 mp -122.24 159.7 50.99 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 127.702 2.401 . . . . 0.0 109.049 174.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -73.97 60.75 4.63 Favored 'Trans proline' 0 CA--C 1.549 1.243 0 C-N-CA 124.574 3.516 . . . . 0.0 113.08 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 76.2 p -103.19 116.45 32.49 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.849 -1.157 . . . . 0.0 113.269 -169.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.0 p -92.54 -175.04 3.86 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.952 1.701 . . . . 0.0 111.461 161.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 46.3 49.07 13.15 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 126.521 1.929 . . . . 0.0 114.015 178.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.16 137.49 53.37 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 120.857 -1.152 . . . . 0.0 112.341 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -154.12 135.55 4.81 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 126.632 2.063 . . . . 0.0 108.151 168.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.9 t -132.48 12.53 4.52 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.041 0.936 . . . . 0.0 112.122 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -77.75 40.08 0.3 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 128.051 2.54 . . . . 0.0 112.797 -173.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.9 m -137.9 143.67 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 125.032 1.333 . . . . 0.0 111.582 -164.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -160.45 110.26 1.76 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.979 1.312 . . . . 0.0 108.862 176.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -77.37 129.34 9.54 Favored Glycine 0 CA--C 1.533 1.159 0 CA-C-O 118.967 -0.907 . . . . 0.0 111.022 166.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.7 t -102.32 46.88 0.91 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 126.475 1.91 . . . . 0.0 109.951 168.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -63.24 163.92 9.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.504 1.122 . . . . 0.0 111.689 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 15.6 p -112.35 149.64 32.18 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.368 1.067 . . . . 0.0 113.072 -173.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.1 t -122.5 129.87 74.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.988 1.715 . . . . 0.0 109.67 -173.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.48 ' HB3' HD22 ' A' ' 86' ' ' ASN . 3.0 t0 -80.74 179.81 7.62 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.997 1.719 . . . . 0.0 112.537 178.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.29 -3.41 0.62 Allowed 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 116.603 2.075 . . . . 0.0 116.603 -172.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.7 m -162.6 64.59 0.21 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.671 1.988 . . . . 0.0 109.864 168.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.72 -123.91 6.4 Favored Glycine 0 CA--C 1.53 1.022 0 O-C-N 121.478 -0.764 . . . . 0.0 111.601 -177.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.48 HD22 ' HB3' ' A' ' 82' ' ' ASP . 7.1 m-80 57.25 179.42 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.848 1.259 . . . . 0.0 112.972 -171.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.79 118.6 36.59 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.242 -0.911 . . . . 0.0 109.376 169.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.8 mt -84.77 160.87 20.18 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 122.145 0.974 . . . . 0.0 111.611 171.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 15.9 mt -80.33 91.64 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 C-N-CA 124.448 1.099 . . . . 0.0 110.4 -173.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 53.4 p -133.24 153.79 51.24 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.699 1.199 . . . . 0.0 110.708 164.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 8.9 tpp85 -70.49 -7.92 47.26 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -162.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -55.36 -44.93 76.45 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 127.108 2.163 . . . . 0.0 115.061 -167.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 39.5 pt -60.4 -28.47 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 123.826 0.851 . . . . 0.0 112.828 -173.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 62.5 ttt-85 -68.55 -35.89 78.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 122.672 0.389 . . . . 0.0 110.95 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -79.24 -34.24 42.88 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.283 0.633 . . . . 0.0 111.804 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.8 mp -56.96 -51.59 68.61 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.889 -0.577 . . . . 0.0 111.509 165.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -61.26 -42.96 99.53 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.956 0.798 . . . . 0.0 111.697 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.02 -41.88 97.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.33 0.968 . . . . 0.0 112.668 -179.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.92 -44.9 96.56 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.276 -0.89 . . . . 0.0 111.824 178.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -83.68 -8.96 59.17 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.2 mt -78.91 -33.19 45.76 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.812 1.187 . . . . 0.0 112.473 169.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 12.5 t -77.07 -38.07 53.26 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.259 0.936 . . . . 0.0 112.274 171.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -89.35 24.13 2.31 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.593 1.157 . . . . 0.0 113.882 171.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 8.4 p -61.67 -25.1 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 O-C-N 121.034 -1.041 . . . . 0.0 113.632 -171.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 110.48 153.34 13.59 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 125.064 1.316 . . . . 0.0 112.341 -176.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -109.5 -12.71 14.67 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.428 1.091 . . . . 0.0 111.28 174.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.492 ' H ' ' HD2' ' A' ' 108' ' ' PRO . 23.8 mm-40 -150.9 -55.52 0.02 OUTLIER Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 128.509 2.724 . . . . 0.0 112.713 173.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.492 ' HD2' ' H ' ' A' ' 107' ' ' GLU . 92.9 Cg_endo -75.14 52.05 3.0 Favored 'Trans proline' 0 CA--C 1.55 1.302 0 C-N-CA 124.542 3.495 . . . . 0.0 115.139 -173.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.65 -40.75 69.31 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 126.467 1.907 . . . . 0.0 112.187 -178.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -63.15 -22.94 67.2 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -93.76 -37.1 11.96 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.004 0.82 . . . . 0.0 113.094 -176.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 75.9 p -63.38 -42.39 98.84 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 122.937 0.495 . . . . 0.0 110.482 173.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.35 -35.81 81.31 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 118.321 -0.847 . . . . 0.0 112.416 177.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -66.52 -41.26 89.05 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 119.47 1.032 . . . . 0.0 112.108 -174.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -69.3 -41.8 76.27 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 120.924 -1.11 . . . . 0.0 112.466 170.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 46.2 tp -51.47 -63.38 1.15 Allowed 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.044 0.537 . . . . 0.0 111.701 175.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -30.66 68.1 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.273 1.029 . . . . 0.0 112.75 177.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.54 -39.9 94.62 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 174.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -62.65 -51.38 67.5 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.062 0.846 . . . . 0.0 111.9 174.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.415 HD12 ' H ' ' A' ' 120' ' ' ILE . 4.4 mp -58.75 -41.53 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.319 0.963 . . . . 0.0 111.118 177.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.1 -18.13 63.94 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -101.32 -33.2 10.13 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -78.52 -45.46 21.87 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.382 1.073 . . . . 0.0 112.45 177.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.431 HD12 ' HB1' ' A' ' 128' ' ' ALA . 2.6 mm? -84.89 174.88 9.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.12 0.968 . . . . 0.0 111.574 176.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.85 -99.99 0.1 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.282 0.633 . . . . 0.0 112.288 -177.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.438 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 17.6 tt0 -135.22 -63.9 0.02 OUTLIER Pre-proline 0 N--CA 1.472 0.657 0 O-C-N 120.807 -1.183 . . . . 0.0 109.138 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.438 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 87.5 Cg_endo -68.58 -34.03 20.66 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 CA-C-N 121.127 1.438 . . . . 0.0 111.702 173.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.431 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -60.75 -36.39 78.8 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 120.77 -1.206 . . . . 0.0 112.078 174.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -63.91 -49.51 72.37 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.509 1.124 . . . . 0.0 110.413 172.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.32 -34.13 73.29 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 124.871 1.224 . . . . 0.0 113.879 178.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -75.08 -33.67 61.69 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.466 1.133 . . . . 0.0 110.682 175.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.47 -46.13 64.36 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.698 -0.626 . . . . 0.0 110.926 -176.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.29 -36.63 79.65 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 118.804 -0.617 . . . . 0.0 112.176 174.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.7 -54.08 49.63 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.301 0.955 . . . . 0.0 111.976 175.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 97.0 mt -58.7 -34.73 71.64 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.395 176.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 49.5 ttp -65.38 -52.02 56.45 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.4 0.68 . . . . 0.0 112.26 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -64.33 -42.9 96.06 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.768 -0.582 . . . . 0.0 111.604 179.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -44.9 95.99 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.604 1.162 . . . . 0.0 111.715 176.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -59.9 -44.48 94.22 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.155 0.434 . . . . 0.0 111.467 174.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 74.6 mt -62.24 -35.32 68.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 118.686 0.675 . . . . 0.0 111.414 176.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -63.02 -32.19 73.5 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.029 0.932 . . . . 0.0 113.111 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 3.5 p90 -108.81 -0.14 20.05 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 116.242 1.941 . . . . 0.0 116.242 174.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -55.47 -43.81 75.86 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.752 1.621 . . . . 0.0 112.634 178.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 42.7 mtpt -111.51 142.13 44.18 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 125.443 1.497 . . . . 0.0 110.759 -176.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -76.83 56.46 1.18 Allowed 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.048 1.339 . . . . 0.0 112.787 -177.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 83.9 mt . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 129.669 3.188 . . . . 0.0 118.087 176.096 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 48.6 m170 . . . . . 0 CA--C 1.54 0.572 0 CA-C-O 120.544 0.212 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.8 mp -128.39 151.5 76.66 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 125.269 1.428 . . . . 0.0 110.926 -177.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -67.32 170.29 13.71 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.211 3.274 . . . . 0.0 113.58 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.9 t -58.81 131.2 50.25 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 122.608 1.194 . . . . 0.0 112.306 -174.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.2 p -178.06 167.23 2.02 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 128.304 2.642 . . . . 0.0 107.274 -167.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -46.99 106.02 0.08 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 123.978 0.911 . . . . 0.0 112.922 -174.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.59 123.79 33.42 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.621 1.168 . . . . 0.0 111.88 -173.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -177.87 141.98 5.41 Favored Glycine 0 CA--C 1.526 0.77 0 C-N-CA 125.678 1.609 . . . . 0.0 110.34 168.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.44 44.68 1.97 Allowed 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 122.871 1.32 . . . . 0.0 110.282 -174.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.5 t -138.92 148.86 44.14 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 127.667 2.387 . . . . 0.0 109.263 173.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 13.3 p -57.92 169.01 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.07 0 C-N-CA 127.132 2.173 . . . . 0.0 112.568 172.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -131.8 -18.65 2.7 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.591 1.556 . . . . 0.0 115.141 -179.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -140.41 144.31 14.69 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.552 1.072 . . . . 0.0 111.623 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.8 t -78.33 74.03 4.87 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.636 1.174 . . . . 0.0 111.397 -179.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -65.78 152.79 43.54 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.801 0.81 . . . . 0.0 111.602 177.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 98.5 p -133.56 157.8 44.77 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.867 0.841 . . . . 0.0 113.002 -173.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.6 t -127.71 130.93 70.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.338 1.455 . . . . 0.0 110.088 -166.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -79.12 173.32 12.7 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.346 1.858 . . . . 0.0 113.632 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.54 -10.12 2.03 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 -177.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 19.8 m -138.29 29.88 2.44 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.793 1.637 . . . . 0.0 111.848 175.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 93.13 -109.08 3.74 Favored Glycine 0 C--N 1.339 0.746 0 O-C-N 120.445 -1.409 . . . . 0.0 110.766 -173.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 128' ' ' ALA . 71.4 m-20 52.05 -172.16 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.679 1.191 . . . . 0.0 113.758 -174.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -113.48 126.03 54.87 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 164.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.5 mt -91.61 140.96 29.23 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.338 0.972 . . . . 0.0 110.27 170.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 31.6 mm -80.68 105.46 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.917 0.865 . . . . 0.0 110.851 -178.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.1 p -132.56 22.63 4.33 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 125.255 1.422 . . . . 0.0 113.247 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 64.24 -4.39 0.41 Allowed 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 126.811 2.045 . . . . 0.0 115.88 177.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -54.78 -53.83 50.08 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 129.23 3.012 . . . . 0.0 114.834 178.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 30.2 pt -54.77 -33.3 27.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 123.928 0.891 . . . . 0.0 113.177 -177.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 69.7 ttt180 -65.01 -38.58 91.41 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.984 1.265 . . . . 0.0 112.217 177.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -67.97 -35.11 77.81 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.238 0.615 . . . . 0.0 111.553 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tt -67.18 -44.02 80.72 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.807 0.843 . . . . 0.0 111.35 174.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -63.6 -43.6 96.44 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.099 0.863 . . . . 0.0 112.693 171.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -58.09 -46.43 85.51 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.599 1.09 . . . . 0.0 112.75 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -58.62 -30.97 67.66 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -102.19 -12.17 18.23 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 24.7 mt -74.86 -41.1 60.46 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.617 1.098 . . . . 0.0 111.376 167.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 5.7 t -67.05 -47.37 71.54 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.322 0.51 . . . . 0.0 110.852 175.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -87.61 23.55 1.92 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.76 1.624 . . . . 0.0 114.996 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 7.2 p -61.33 -25.57 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 N-CA-C 114.22 1.192 . . . . 0.0 114.22 -171.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.06 178.65 49.92 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.549 1.071 . . . . 0.0 113.699 -177.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -134.78 -61.44 0.76 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.373 1.069 . . . . 0.0 109.727 -175.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -77.79 -54.16 1.39 Allowed Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 124.572 1.149 . . . . 0.0 113.771 168.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -77.89 33.34 0.45 Allowed 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 124.292 3.328 . . . . 0.0 114.267 -175.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.28 -35.89 63.05 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.503 1.921 . . . . 0.0 113.126 -171.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.83 -40.76 92.07 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.364 -0.835 . . . . 0.0 112.698 177.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -83.77 -28.56 28.08 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 121.013 -1.054 . . . . 0.0 112.971 -172.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 68.6 p -65.13 -44.92 87.11 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 118.56 0.618 . . . . 0.0 111.181 175.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.8 -27.89 66.28 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 122.555 0.342 . . . . 0.0 111.617 175.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -72.22 -46.75 54.79 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 111.417 0.154 . . . . 0.0 111.417 -174.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -66.23 -35.47 80.51 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 118.451 -0.785 . . . . 0.0 111.821 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.466 ' O ' HD12 ' A' ' 120' ' ' ILE . 55.3 tp -57.94 -61.81 2.27 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.623 0.769 . . . . 0.0 111.025 176.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -60.58 -27.79 67.97 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.278 -0.889 . . . . 0.0 112.726 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.07 -37.53 66.76 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.86 0.864 . . . . 0.0 113.044 173.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -63.68 -53.38 52.22 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.096 -0.954 . . . . 0.0 111.499 174.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.466 HD12 ' O ' ' A' ' 116' ' ' LEU . 3.7 mp -55.79 -36.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 120.633 1.56 . . . . 0.0 111.537 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.451 ' HA ' ' HD2' ' A' ' 129' ' ' ARG . . . -70.68 -24.78 62.74 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 115.537 1.68 . . . . 0.0 115.537 178.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -99.22 -29.31 12.9 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.997 1.319 . . . . 0.0 113.785 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -82.26 -46.14 14.08 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.484 1.514 . . . . 0.0 113.694 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 7.5 mp -89.21 176.3 7.01 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.02 0.928 . . . . 0.0 110.495 171.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.38 -96.94 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.941 0.896 . . . . 0.0 111.767 -175.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.47 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 34.7 tt0 -155.03 -52.65 0.02 OUTLIER Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 124.96 1.304 . . . . 0.0 110.909 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.47 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 56.7 Cg_endo -64.78 -43.9 11.59 Favored 'Trans proline' 0 C--N 1.353 0.804 0 CA-C-N 121.673 1.633 . . . . 0.0 109.948 167.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 86' ' ' ASN . . . -49.97 -38.83 38.68 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.851 1.261 . . . . 0.0 113.007 172.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.463 HH11 ' HD3' ' A' ' 129' ' ' ARG . 26.5 ttt180 -72.19 -42.53 65.73 Favored 'General case' 0 N--CA 1.456 -0.156 0 O-C-N 121.602 -0.686 . . . . 0.0 110.869 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.8 -32.62 75.08 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-O 119.524 -0.598 . . . . 0.0 113.976 175.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -79.28 -30.35 42.93 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.34 1.07 . . . . 0.0 111.29 175.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.36 -46.91 63.16 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.646 -0.659 . . . . 0.0 111.109 -178.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.7 pp -66.79 -36.63 82.85 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.308 0.643 . . . . 0.0 112.393 175.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.99 -52.0 64.67 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.659 -0.65 . . . . 0.0 112.426 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.86 -28.82 69.76 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.489 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 9.4 tmm? -67.36 -53.47 29.19 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.044 0.838 . . . . 0.0 112.105 175.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.59 -42.32 98.69 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.07 -1.019 . . . . 0.0 113.363 172.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.37 -42.29 96.25 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.167 0.987 . . . . 0.0 111.959 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 32.7 t80 -59.56 -43.83 93.46 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.751 -0.593 . . . . 0.0 111.242 171.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.11 -41.74 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 CA-C-O 118.667 -0.683 . . . . 0.0 112.132 -178.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -61.16 -49.91 75.31 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.091 0.956 . . . . 0.0 111.523 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.9 m-30 -89.01 6.62 38.84 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -175.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -64.8 -32.74 74.58 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.194 1.397 . . . . 0.0 112.188 174.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -85.47 134.38 34.06 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.4 1.88 . . . . 0.0 110.683 176.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -89.53 43.36 1.14 Allowed 'General case' 0 N--CA 1.479 0.991 0 O-C-N 121.1 -1.0 . . . . 0.0 113.056 170.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 7.1 mp . . . . . 0 CA--C 1.556 1.179 0 N-CA-C 116.714 2.116 . . . . 0.0 116.714 173.508 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 12.5 t-160 . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 70.2 mt 49.71 70.9 1.77 Allowed Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 125.196 1.398 . . . . 0.0 113.624 -178.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -59.5 131.04 38.31 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 122.013 1.808 . . . . 0.0 110.556 170.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.8 t -147.39 -12.75 0.4 Allowed 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -167.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.5 t -79.21 129.68 34.71 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.316 0.962 . . . . 0.0 111.877 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -80.21 144.07 33.24 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.209 1.004 . . . . 0.0 112.788 -178.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.22 -26.85 68.02 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -176.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -116.6 -167.27 14.62 Favored Glycine 0 CA--C 1.532 1.104 0 C-N-CA 125.383 1.468 . . . . 0.0 112.405 176.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.3 p -92.94 92.17 7.74 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.273 -1.134 . . . . 0.0 111.943 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.2 t -159.36 143.95 15.37 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.349 1.06 . . . . 0.0 111.663 168.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 15.7 m -157.22 165.77 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 127.504 2.322 . . . . 0.0 110.679 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.86 -38.0 77.77 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.997 2.119 . . . . 0.0 115.912 -174.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 77.63 -141.08 25.12 Favored Glycine 0 CA--C 1.547 2.062 0 C-N-CA 125.503 1.525 . . . . 0.0 114.834 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.4 t -148.7 155.3 40.83 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.868 2.067 . . . . 0.0 109.886 -175.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.803 ' HA ' ' OD1' ' A' ' 92' ' ' ASP . 6.6 p90 -147.54 172.96 13.17 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -164.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 94.0 p -88.29 168.03 13.05 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.821 2.049 . . . . 0.0 114.883 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 3.6 p -154.22 136.89 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 125.541 1.537 . . . . 0.0 111.484 -177.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -84.35 170.95 13.1 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.632 1.173 . . . . 0.0 111.579 173.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.96 3.76 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 117.688 2.477 . . . . 0.0 117.688 -170.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 39.5 m -159.22 52.09 0.38 Allowed 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.008 1.723 . . . . 0.0 110.109 168.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.89 -124.35 6.43 Favored Glycine 0 CA--C 1.528 0.899 0 O-C-N 120.2 -1.562 . . . . 0.0 111.228 -174.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 59.79 177.8 0.09 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.333 1.053 . . . . 0.0 111.615 -169.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.1 mt -112.14 128.23 56.16 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.824 -1.172 . . . . 0.0 109.536 170.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mt -95.52 161.83 13.9 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 121.992 0.901 . . . . 0.0 111.807 176.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.4 mm -83.87 89.64 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 124.599 1.16 . . . . 0.0 111.494 -173.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 69.3 p -141.62 166.43 24.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.709 175.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.418 ' CG ' ' HD3' ' A' ' 94' ' ' ARG . 43.7 ttm-85 -93.02 45.41 1.18 Allowed 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 115.005 -0.998 . . . . 0.0 113.398 -164.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.803 ' OD1' ' HA ' ' A' ' 79' ' ' PHE . 0.2 OUTLIER -102.71 -60.16 1.59 Allowed 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.614 -0.679 . . . . 0.0 112.691 -178.358 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 20.8 pt -47.41 -24.04 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -176.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.418 ' HD3' ' CG ' ' A' ' 91' ' ' ARG . 9.5 ptm85 -74.06 -31.03 62.69 Favored 'General case' 0 N--CA 1.456 -0.127 0 O-C-N 120.896 -1.127 . . . . 0.0 111.249 -177.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -74.4 -32.03 62.55 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.317 1.047 . . . . 0.0 111.032 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.3 tt -63.44 -52.75 60.14 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.577 1.551 . . . . 0.0 110.661 176.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -56.58 -46.01 81.02 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.295 -0.878 . . . . 0.0 112.731 169.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.57 -38.87 85.98 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 119.661 1.119 . . . . 0.0 112.55 -179.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.82 -37.17 83.45 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.189 0.996 . . . . 0.0 112.982 178.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -99.85 -3.66 32.07 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 34.7 mt -82.85 -24.06 33.42 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.194 -0.942 . . . . 0.0 112.892 166.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 70.2 m -85.09 138.76 32.21 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 170.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 59.23 18.21 6.38 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 116.307 1.965 . . . . 0.0 116.307 166.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 11.7 p -53.44 -28.45 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 -167.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 170.75 151.11 7.35 Favored Glycine 0 CA--C 1.526 0.758 0 C-N-CA 125.327 1.442 . . . . 0.0 110.357 175.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -82.88 -39.22 21.85 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 117.273 0.536 . . . . 0.0 112.131 -179.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -156.19 -56.06 0.02 OUTLIER Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 125.994 1.718 . . . . 0.0 113.272 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -71.34 69.43 2.58 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 124.589 3.526 . . . . 0.0 113.293 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.21 75.81 1.3 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.019 1.327 . . . . 0.0 111.485 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -128.74 -76.11 0.56 Allowed 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.888 1.275 . . . . 0.0 110.868 169.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.72 -29.98 70.46 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -167.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.1 m -57.85 -46.03 85.38 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.234 0.924 . . . . 0.0 112.154 174.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.73 -36.75 76.14 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 122.396 0.278 . . . . 0.0 110.438 178.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -65.33 -37.12 86.13 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 122.698 0.399 . . . . 0.0 111.48 -176.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -72.14 -45.01 62.23 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 117.568 -1.206 . . . . 0.0 111.767 172.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 42.6 tp -49.47 -63.36 1.13 Allowed 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 118.995 0.816 . . . . 0.0 111.791 176.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -60.8 -30.91 70.34 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.911 -1.118 . . . . 0.0 112.709 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -67.38 -38.03 84.1 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 175.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -60.33 -51.2 70.51 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 119.15 0.886 . . . . 0.0 111.131 173.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.5 mp -58.59 -42.26 84.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-N 119.107 0.867 . . . . 0.0 111.318 175.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.02 -20.97 63.24 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 115.344 1.609 . . . . 0.0 115.344 -178.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -98.05 -37.39 9.77 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.881 1.272 . . . . 0.0 113.218 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -73.12 -52.43 14.26 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.724 0.81 . . . . 0.0 112.979 173.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -83.83 159.18 21.44 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 122.4 1.095 . . . . 0.0 109.983 175.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -77.67 -84.41 0.07 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.423 -169.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -153.72 -61.6 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 117.961 -1.018 . . . . 0.0 110.405 -178.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -66.65 -38.33 18.83 Favored 'Trans proline' 0 C--N 1.352 0.761 0 CA-C-N 121.437 1.549 . . . . 0.0 110.731 170.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.14 -35.11 71.03 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 121.024 -1.047 . . . . 0.0 112.743 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 35.3 ttt180 -63.4 -47.62 81.23 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.879 1.272 . . . . 0.0 110.379 172.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.06 -34.72 73.77 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.258 1.408 . . . . 0.0 114.148 177.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -75.64 -32.8 60.37 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.356 1.078 . . . . 0.0 110.725 175.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.96 -46.69 64.73 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.734 -0.604 . . . . 0.0 110.968 -177.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.53 -35.35 77.34 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.37 -53.45 56.45 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.488 0.586 . . . . 0.0 112.064 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 88.4 mt -58.47 -34.1 70.5 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.246 176.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 44.1 ttp -65.53 -50.5 64.99 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.294 0.638 . . . . 0.0 112.469 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -64.65 -44.35 90.72 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.145 0.884 . . . . 0.0 112.172 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.2 -38.79 90.47 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.145 0.978 . . . . 0.0 111.426 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -62.92 -45.99 89.88 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.152 -0.968 . . . . 0.0 111.777 171.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 70.3 mt -64.96 -34.84 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 121.277 -0.89 . . . . 0.0 112.561 -177.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -61.51 -65.14 0.74 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.715 1.206 . . . . 0.0 110.356 169.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 12.4 m-30 -76.26 -2.94 33.87 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.893 1.277 . . . . 0.0 114.234 -171.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -55.73 -31.72 62.75 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.636 1.575 . . . . 0.0 112.035 170.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -89.22 126.21 35.4 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.443 1.097 . . . . 0.0 110.152 171.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -77.44 68.81 3.61 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.93 -0.481 . . . . 0.0 110.917 169.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 33.1 mt . . . . . 0 CA--C 1.547 0.855 0 C-N-CA 128.805 2.842 . . . . 0.0 118.183 175.309 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 24.0 m80 . . . . . 0 N--CA 1.469 0.5 0 CA-C-O 120.686 0.279 . . . . 0.0 111.393 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.6 tp -134.68 87.1 32.09 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 124.65 1.18 . . . . 0.0 110.94 177.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -64.95 145.72 86.18 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 121.865 1.71 . . . . 0.0 109.868 165.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.8 t -152.73 131.4 12.32 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 121.242 -0.911 . . . . 0.0 112.832 -167.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 55.9 p -87.7 51.45 2.22 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.94 1.696 . . . . 0.0 113.337 -176.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -80.42 160.7 25.25 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.257 -0.902 . . . . 0.0 112.395 172.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.82 128.03 32.94 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 167.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -69.81 93.39 0.39 Allowed Glycine 0 CA--C 1.535 1.326 0 C-N-CA 123.823 0.725 . . . . 0.0 113.745 -173.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.9 t -151.61 161.98 41.76 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.111 1.364 . . . . 0.0 111.93 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 53.9 m -78.05 161.35 27.51 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.389 1.076 . . . . 0.0 112.937 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 35.0 m -122.67 140.94 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 125.157 1.383 . . . . 0.0 111.987 -178.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -80.27 30.49 0.28 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.68 1.192 . . . . 0.0 113.213 173.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -73.11 31.24 0.78 Allowed Glycine 0 CA--C 1.538 1.519 0 O-C-N 120.105 -1.622 . . . . 0.0 116.564 -167.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.0 t -82.96 56.71 3.56 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 119.294 1.547 . . . . 0.0 113.662 -170.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -66.31 170.28 6.15 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.161 -0.962 . . . . 0.0 112.573 173.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.1 p -110.38 161.1 15.98 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.959 1.304 . . . . 0.0 113.418 176.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.9 t -123.27 135.56 62.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 125.701 1.6 . . . . 0.0 109.748 -175.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -80.42 173.66 12.38 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.571 1.549 . . . . 0.0 112.767 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.5 -28.73 32.61 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -170.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.8 m -128.88 43.42 3.15 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.588 1.955 . . . . 0.0 111.029 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.25 -122.12 5.84 Favored Glycine 0 CA--C 1.528 0.9 0 O-C-N 120.938 -1.101 . . . . 0.0 111.288 -174.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 56.12 -176.58 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.319 1.048 . . . . 0.0 113.562 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mt -110.1 133.63 53.01 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.214 -0.928 . . . . 0.0 109.575 173.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 12.8 mt -106.31 144.36 33.12 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 122.005 0.907 . . . . 0.0 110.693 169.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 23.4 mt -64.95 113.63 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 124.151 0.98 . . . . 0.0 110.238 -173.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -143.19 142.09 31.33 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.205 1.402 . . . . 0.0 111.344 -175.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 27.0 ttm180 -65.88 -25.49 67.2 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.507 1.123 . . . . 0.0 112.972 -173.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.43 -29.89 68.08 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 128.649 2.78 . . . . 0.0 112.334 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 82.1 mt -56.27 -39.06 57.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.336 1.054 . . . . 0.0 111.647 173.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -68.22 -35.88 78.66 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 121.006 -1.059 . . . . 0.0 112.362 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -66.23 -31.31 72.05 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.058 0.543 . . . . 0.0 111.251 173.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.36 -44.63 78.53 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.944 0.897 . . . . 0.0 111.457 179.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -63.87 -44.96 91.5 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 118.285 -0.864 . . . . 0.0 113.176 167.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -39.79 94.48 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-N 120.624 1.556 . . . . 0.0 112.453 -177.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.94 -13.05 42.8 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -113.95 -12.17 12.68 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.546 1.138 . . . . 0.0 113.241 172.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 34.0 mt -78.9 -39.53 34.72 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.385 0.993 . . . . 0.0 111.484 172.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.1 p -66.86 -41.09 87.91 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.986 0.812 . . . . 0.0 110.95 171.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -83.58 21.38 1.23 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.022 1.729 . . . . 0.0 114.603 176.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 12.0 p -55.07 -33.39 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 C-N-CA 124.763 1.225 . . . . 0.0 113.683 -173.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 123.33 115.93 2.25 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.708 1.146 . . . . 0.0 113.298 170.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -73.3 -18.73 61.17 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.138 0.975 . . . . 0.0 112.951 175.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.445 ' H ' ' HD2' ' A' ' 108' ' ' PRO . 15.8 mt-10 -145.99 -59.85 0.02 OUTLIER Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 127.848 2.459 . . . . 0.0 112.279 175.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.445 ' HD2' ' H ' ' A' ' 107' ' ' GLU . 68.7 Cg_endo -78.43 53.32 4.5 Favored 'Trans proline' 0 CA--C 1.548 1.182 0 C-N-CA 123.946 3.098 . . . . 0.0 114.489 -170.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 40.2 tp -51.88 -47.64 64.42 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.913 1.685 . . . . 0.0 113.23 -177.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -58.86 -35.24 72.63 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.291 1.036 . . . . 0.0 112.621 177.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -79.87 -31.93 40.41 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.231 -0.918 . . . . 0.0 112.169 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.4 t -65.48 -43.52 90.0 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 122.762 0.425 . . . . 0.0 111.877 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.17 -35.53 81.1 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 121.921 -0.487 . . . . 0.0 111.514 173.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -65.87 -46.06 79.84 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.957 0.503 . . . . 0.0 110.519 -176.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 19.5 ptt-85 -64.74 -31.08 72.15 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 117.846 -1.073 . . . . 0.0 113.356 171.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.21 -61.27 2.48 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.563 1.074 . . . . 0.0 109.995 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 -59.35 -29.69 67.85 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.508 1.123 . . . . 0.0 113.189 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -69.03 -45.21 71.03 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.602 0.761 . . . . 0.0 112.183 173.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -53.42 -48.97 68.26 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.066 0.946 . . . . 0.0 112.597 176.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.438 HG22 ' HG3' ' A' ' 129' ' ' ARG . 3.9 mp -62.12 -38.62 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 O-C-N 121.372 -0.83 . . . . 0.0 111.864 175.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.66 -24.63 61.06 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -83.64 -42.37 16.76 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.684 1.194 . . . . 0.0 112.486 173.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -79.12 -46.94 17.01 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.702 1.201 . . . . 0.0 113.04 -178.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.484 HD12 ' HB1' ' A' ' 128' ' ' ALA . 2.2 mm? -88.27 171.77 9.93 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 122.654 1.216 . . . . 0.0 110.935 177.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.92 -108.16 0.09 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.736 1.215 . . . . 0.0 111.749 -176.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.445 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 47.7 tt0 -126.68 -63.9 0.02 OUTLIER Pre-proline 0 N--CA 1.47 0.552 0 O-C-N 120.337 -1.477 . . . . 0.0 108.975 -175.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.445 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 72.5 Cg_endo -68.78 -38.37 10.35 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 120.764 1.309 . . . . 0.0 111.568 173.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.484 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -59.9 -29.65 68.49 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.028 -1.045 . . . . 0.0 111.957 177.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.438 ' HG3' HG22 ' A' ' 120' ' ' ILE . 51.6 ttt180 -72.73 -45.45 58.63 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.942 0.401 . . . . 0.0 110.183 177.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.57 -35.49 80.73 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 115.459 -0.792 . . . . 0.0 113.762 176.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -72.65 -34.59 67.38 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.467 1.134 . . . . 0.0 110.747 175.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.03 -44.02 61.31 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.167 0.587 . . . . 0.0 111.285 -174.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -69.6 -36.18 75.98 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 119.032 -0.508 . . . . 0.0 112.074 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.66 -53.56 54.55 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 119.067 0.849 . . . . 0.0 111.782 174.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.4 mt -56.29 -35.29 67.34 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.679 0.792 . . . . 0.0 111.501 175.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 53.4 ttp -66.86 -51.3 57.12 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.434 0.693 . . . . 0.0 112.561 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -64.44 -40.8 96.44 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.436 -0.79 . . . . 0.0 111.66 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.06 -43.68 98.3 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.84 1.256 . . . . 0.0 111.377 176.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -60.35 -45.21 94.28 Favored 'General case' 0 C--O 1.221 -0.426 0 O-C-N 121.636 -0.665 . . . . 0.0 111.241 173.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 85.5 mt -67.94 -34.34 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 123.743 0.817 . . . . 0.0 112.861 -178.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -69.58 -49.69 51.75 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.617 0.767 . . . . 0.0 111.406 172.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 14.0 m-30 -79.93 -0.42 34.96 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.125 -0.984 . . . . 0.0 113.49 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -56.84 -26.21 57.84 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 126.441 1.896 . . . . 0.0 113.316 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -159.07 139.67 12.47 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.715 1.606 . . . . 0.0 112.418 167.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -86.0 18.71 2.89 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 125.162 1.385 . . . . 0.0 112.479 165.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 47.8 mt . . . . . 0 N--CA 1.479 1.011 0 C-N-CA 128.023 2.529 . . . . 0.0 116.719 178.425 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 . . . . . 0 CA--C 1.545 0.781 0 CA-C-O 119.317 -0.373 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 27.6 tp -124.62 68.53 52.35 Favored Pre-proline 0 CA--C 1.557 1.237 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -167.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -62.91 125.08 15.18 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.974 2.449 . . . . 0.0 111.396 177.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 8.9 p -158.32 161.29 37.63 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 126.545 1.938 . . . . 0.0 110.79 -169.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 79.5 p -69.68 145.2 52.55 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.091 0.86 . . . . 0.0 113.098 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.3 p90 -163.02 171.66 16.16 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.507 1.523 . . . . 0.0 111.977 173.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 17.6 mtt180 -88.86 -57.77 2.79 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 125.152 1.381 . . . . 0.0 112.741 167.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -163.19 21.99 0.17 Allowed Glycine 0 CA--C 1.534 1.239 0 N-CA-C 116.377 1.311 . . . . 0.0 116.377 -175.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.2 p 48.41 37.58 9.07 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 115.429 1.64 . . . . 0.0 115.429 173.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 44.7 t -109.45 141.72 41.47 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.087 1.355 . . . . 0.0 111.444 176.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 16.4 m -149.24 142.35 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 126.728 2.011 . . . . 0.0 110.183 177.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -94.51 24.79 4.31 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.023 1.329 . . . . 0.0 113.304 176.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -59.18 118.38 14.07 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.434 1.016 . . . . 0.0 112.776 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.4 t -150.63 21.83 0.81 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.072 1.749 . . . . 0.0 113.405 -165.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -50.08 156.66 0.75 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 128.509 2.724 . . . . 0.0 114.432 175.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.7 p -106.27 157.81 17.32 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.547 1.139 . . . . 0.0 112.995 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.5 t -124.45 129.92 73.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.374 1.47 . . . . 0.0 110.0 -171.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -77.32 171.01 15.53 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.985 2.114 . . . . 0.0 113.138 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.14 2.71 0.08 Allowed 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 127.72 2.408 . . . . 0.0 116.373 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 42.7 m -154.05 37.26 0.44 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.529 1.931 . . . . 0.0 111.31 169.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.84 -103.84 3.1 Favored Glycine 0 CA--C 1.527 0.789 0 O-C-N 120.872 -1.143 . . . . 0.0 111.854 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 49.89 -166.89 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.304 1.442 . . . . 0.0 112.88 -172.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mt -122.56 129.99 52.53 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 120.598 -1.314 . . . . 0.0 108.214 162.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.8 mt -99.66 143.3 30.05 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.996 0.903 . . . . 0.0 111.388 174.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 48.3 mm -61.31 125.04 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 123.901 0.88 . . . . 0.0 110.91 -174.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.5 p -155.39 150.6 26.9 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.487 1.915 . . . . 0.0 110.335 -168.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 30.3 ttm180 -88.45 -12.16 43.91 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 -168.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -67.87 -29.38 68.48 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 117.613 -1.184 . . . . 0.0 111.803 169.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 45.4 mm -51.62 -36.56 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 119.972 1.26 . . . . 0.0 112.064 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.4 ttt85 -74.58 -41.16 60.99 Favored 'General case' 0 CA--C 1.521 -0.15 0 O-C-N 121.007 -1.058 . . . . 0.0 110.775 178.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -64.78 -28.28 69.47 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.437 176.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 tt -64.77 -47.75 77.01 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.478 1.511 . . . . 0.0 110.866 174.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -66.68 -42.3 86.75 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.61 -0.682 . . . . 0.0 112.451 171.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -58.12 -43.91 87.44 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.574 1.079 . . . . 0.0 112.842 177.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.69 -34.33 75.57 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -175.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -88.04 -32.19 18.91 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.525 1.13 . . . . 0.0 113.001 178.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 44.8 mt -57.21 -51.06 70.87 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.824 1.193 . . . . 0.0 110.696 170.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 62.6 m -68.69 -6.28 25.26 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.75 -2.89 24.28 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.795 1.406 . . . . 0.0 114.795 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 4.4 p -91.08 -47.41 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 119.88 1.218 . . . . 0.0 112.948 176.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 59.81 -111.39 3.48 Favored Glycine 0 CA--C 1.536 1.372 0 CA-C-N 119.031 0.832 . . . . 0.0 111.77 -173.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -106.73 7.79 30.61 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.011 1.324 . . . . 0.0 113.475 174.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -70.2 160.45 80.76 Favored Pre-proline 0 N--CA 1.464 0.267 0 O-C-N 120.054 -1.653 . . . . 0.0 111.331 177.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -69.83 131.3 20.86 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 122.324 2.016 . . . . 0.0 111.886 174.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.12 -26.77 66.51 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.377 1.071 . . . . 0.0 112.335 -179.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 25.9 mm100 -50.85 -54.08 26.86 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.225 1.41 . . . . 0.0 114.219 -174.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.57 -33.1 58.5 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.022 -1.049 . . . . 0.0 113.499 176.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 50.4 m -60.61 -38.88 86.16 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.547 0.739 . . . . 0.0 111.575 178.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.29 -32.85 59.01 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 118.507 -0.758 . . . . 0.0 111.528 173.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.58 -47.07 83.02 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.569 0.622 . . . . 0.0 110.508 -175.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.71 -39.34 84.37 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 121.42 -0.8 . . . . 0.0 112.94 172.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 35.2 tp -59.65 -57.71 11.77 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.542 1.065 . . . . 0.0 111.917 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -23.24 66.76 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.61 -31.14 32.63 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.316 1.046 . . . . 0.0 113.04 176.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.66 -44.45 56.77 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.546 0.739 . . . . 0.0 110.484 173.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 15.3 mt -57.59 -41.26 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 CA-C-O 121.525 0.679 . . . . 0.0 111.533 173.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.46 -21.31 66.63 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -95.02 -23.12 17.5 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 176.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -90.64 -40.35 11.95 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 35.3 mt -83.81 179.7 7.51 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.776 2.031 . . . . 0.0 113.301 177.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -91.43 -96.05 0.12 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.63 1.172 . . . . 0.0 112.167 -173.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.489 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 35.3 tt0 -140.85 -62.22 0.02 OUTLIER Pre-proline 0 N--CA 1.47 0.558 0 O-C-N 120.716 -1.24 . . . . 0.0 109.956 170.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.489 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 59.8 Cg_endo -65.57 -35.76 36.73 Favored 'Trans proline' 0 C--N 1.352 0.761 0 CA-C-N 121.276 1.491 . . . . 0.0 111.106 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -47.84 -47.74 31.25 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.999 1.319 . . . . 0.0 112.628 168.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -62.76 -48.03 80.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.965 1.306 . . . . 0.0 110.458 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.13 -34.77 74.43 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 124.568 1.08 . . . . 0.0 113.649 178.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -75.77 -33.48 60.2 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.483 1.142 . . . . 0.0 110.986 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.2 61.2 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.691 -0.63 . . . . 0.0 111.055 -174.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -67.05 -36.84 82.94 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.967 173.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.11 -55.18 35.45 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 119.378 0.99 . . . . 0.0 111.312 175.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 92.4 mt -53.79 -36.63 62.64 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.283 1.033 . . . . 0.0 111.847 174.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 40.9 ttp -67.2 -50.6 60.3 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.648 0.658 . . . . 0.0 112.353 178.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -43.58 93.39 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.454 -0.778 . . . . 0.0 111.271 177.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.93 -39.09 93.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.604 1.562 . . . . 0.0 112.377 178.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -64.06 -39.99 95.28 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.167 -0.958 . . . . 0.0 111.985 173.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 83.9 mt -72.18 -35.07 51.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.233 1.013 . . . . 0.0 112.059 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 62.0 t0 -62.42 -62.59 1.65 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.07 2.148 . . . . 0.0 110.81 172.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -78.87 -1.21 33.96 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -177.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 23.0 ttmt -48.67 -45.13 38.4 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.715 1.206 . . . . 0.0 112.878 -173.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.05 161.93 39.5 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 127.841 2.456 . . . . 0.0 112.871 -178.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 56.08 34.3 23.53 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.679 1.192 . . . . 0.0 111.686 -177.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 24.9 mt . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 117.044 2.239 . . . . 0.0 117.044 175.95 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 73.2 m80 . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.6 tt -160.88 82.61 2.03 Favored Pre-proline 0 CA--C 1.558 1.276 0 C-N-CA 125.836 1.655 . . . . 0.0 110.759 172.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -79.46 131.24 9.39 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.231 2.621 . . . . 0.0 113.188 -175.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.4 p -56.09 -56.66 18.08 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -158.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.8 t -163.84 -174.75 3.77 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.934 1.294 . . . . 0.0 111.462 -175.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -63.68 -59.48 4.54 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.5 1.12 . . . . 0.0 111.579 173.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 50.3 mtt180 -147.8 130.04 15.59 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.517 1.927 . . . . 0.0 109.891 175.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.94 165.38 8.92 Favored Glycine 0 CA--C 1.538 1.504 0 C-N-CA 124.999 1.285 . . . . 0.0 114.935 -178.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 26.9 p -107.99 78.82 1.21 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.223 1.409 . . . . 0.0 110.652 175.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 40.8 m -131.21 133.71 45.76 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.344 1.058 . . . . 0.0 111.446 -179.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.4 m -145.52 152.96 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 126.902 2.081 . . . . 0.0 108.786 171.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -85.02 -100.66 0.06 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.231 0.613 . . . . 0.0 110.437 175.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 83.58 29.03 33.78 Favored Glycine 0 CA--C 1.542 1.735 0 O-C-N 120.841 -1.162 . . . . 0.0 113.789 -176.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.3 t -76.21 34.77 0.13 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.816 1.246 . . . . 0.0 113.403 170.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -77.53 -176.02 4.07 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.917 1.287 . . . . 0.0 112.083 176.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.5 p -147.36 166.42 27.19 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 120.574 -1.328 . . . . 0.0 112.772 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.3 p -135.66 130.28 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.063 1.745 . . . . 0.0 111.379 -165.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -75.38 168.97 18.98 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 126.701 2.0 . . . . 0.0 112.548 172.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -50.29 -17.25 0.42 Allowed 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 118.021 2.6 . . . . 0.0 118.021 -176.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.9 m -139.09 41.9 2.09 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 127.411 2.285 . . . . 0.0 111.674 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 92.38 -123.93 7.48 Favored Glycine 0 C--N 1.35 1.338 0 O-C-N 119.524 -1.985 . . . . 0.0 110.372 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 62.7 m-20 55.92 -178.94 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.584 1.153 . . . . 0.0 112.677 -171.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.48 114.84 28.22 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 172.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 12.1 mt -83.49 148.39 27.26 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 122.161 0.981 . . . . 0.0 111.951 175.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 22.9 mt -66.51 101.19 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 124.612 1.165 . . . . 0.0 110.089 -173.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -145.96 138.96 25.84 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.652 1.581 . . . . 0.0 110.086 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 34.5 ttp180 -78.29 42.35 0.41 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.119 1.368 . . . . 0.0 113.739 -170.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -89.33 -59.59 2.18 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.292 1.037 . . . . 0.0 113.317 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.0 pt -54.31 -31.3 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.426 1.49 . . . . 0.0 114.297 -167.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -60.09 -40.43 89.58 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.644 -0.66 . . . . 0.0 112.299 176.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -73.82 -32.39 63.68 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.52 0.728 . . . . 0.0 109.741 -173.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.1 mp -60.77 -51.01 71.16 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.619 0.767 . . . . 0.0 110.885 167.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.6 m-30 -60.17 -45.27 93.67 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 118.382 -0.818 . . . . 0.0 112.292 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -62.68 -38.05 88.83 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.536 1.134 . . . . 0.0 112.659 178.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.11 -41.29 97.3 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.206 0.912 . . . . 0.0 111.902 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -84.61 -28.24 26.65 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.571 -0.705 . . . . 0.0 112.665 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 43.8 mt -59.01 -33.29 70.55 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.643 1.11 . . . . 0.0 111.195 166.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.2 m -82.47 9.06 9.96 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.595 1.558 . . . . 0.0 113.952 175.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -149.4 38.8 0.79 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 126.042 1.737 . . . . 0.0 112.969 -174.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 9.1 p -141.2 3.39 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 C-N-CA 125.443 1.497 . . . . 0.0 113.891 -177.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -92.74 -20.16 35.06 Favored Glycine 0 CA--C 1.538 1.501 0 O-C-N 120.938 -1.101 . . . . 0.0 114.757 176.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -107.64 -32.44 7.67 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.734 1.214 . . . . 0.0 111.04 171.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -74.01 149.76 87.67 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 125.861 1.664 . . . . 0.0 114.045 -176.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -66.98 119.55 6.58 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.742 2.294 . . . . 0.0 111.438 171.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -51.61 -44.32 62.85 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 127.307 2.243 . . . . 0.0 111.895 -172.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -58.98 -39.84 82.98 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.973 1.309 . . . . 0.0 113.176 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -85.61 -36.11 20.56 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 121.595 -0.691 . . . . 0.0 111.884 -178.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 78.6 p -63.24 -41.48 99.08 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.119 178.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.29 -33.86 73.83 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.781 0.719 . . . . 0.0 112.493 176.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.79 -44.69 76.78 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 118.568 0.622 . . . . 0.0 111.956 -171.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 33.2 ptt180 -70.09 -32.68 70.86 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 118.625 -0.702 . . . . 0.0 112.881 171.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.4 tt -57.52 -60.38 3.75 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.966 0.803 . . . . 0.0 109.991 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -57.56 -31.92 66.6 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.804 0.841 . . . . 0.0 112.162 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.4 -37.52 80.41 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.118 0.567 . . . . 0.0 112.173 -177.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -61.18 -50.13 74.37 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.492 171.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.402 HD12 ' H ' ' A' ' 120' ' ' ILE . 4.3 mp -60.15 -39.49 80.68 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.413 0 CA-C-N 119.161 0.891 . . . . 0.0 111.578 177.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.85 -21.46 63.35 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -99.59 -21.38 15.9 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.73 1.212 . . . . 0.0 114.167 176.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -104.68 -38.12 6.83 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 120.357 -0.537 . . . . 0.0 112.237 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -87.67 156.63 19.38 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 122.491 1.139 . . . . 0.0 110.096 169.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.61 -88.47 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.944 0.898 . . . . 0.0 112.371 -166.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -150.07 -58.48 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.735 0 O-C-N 121.096 -1.003 . . . . 0.0 111.01 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -69.66 -36.24 11.43 Favored 'Trans proline' 0 C--N 1.353 0.776 0 CA-C-N 121.637 1.621 . . . . 0.0 111.113 167.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -58.97 -39.46 81.81 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 120.945 -1.097 . . . . 0.0 111.847 173.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 43.2 ttt180 -60.4 -51.24 70.33 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.211 1.405 . . . . 0.0 110.167 172.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -60.0 -31.02 71.32 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.018 1.294 . . . . 0.0 114.57 178.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.68 -30.23 41.05 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 118.768 1.284 . . . . 0.0 111.039 173.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.92 -44.3 55.51 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.414 -0.804 . . . . 0.0 111.138 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.2 pp -66.99 -34.78 78.5 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 174.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.54 -56.36 22.27 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.003 0.521 . . . . 0.0 111.206 172.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 7.9 mp -58.45 -33.18 69.44 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.568 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 49.8 ttp -63.3 -48.21 79.03 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.708 0.803 . . . . 0.0 112.887 175.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -75.36 -29.54 59.94 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 120.761 -1.212 . . . . 0.0 112.775 176.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -41.99 76.63 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 124.873 1.269 . . . . 0.0 110.703 -178.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -35.24 79.63 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.687 -0.633 . . . . 0.0 111.072 176.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 87.8 mt -65.77 -40.31 87.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.797 0.839 . . . . 0.0 110.952 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -60.01 -19.28 51.73 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.442 1.097 . . . . 0.0 113.918 177.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -118.77 3.84 11.6 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.414 1.485 . . . . 0.0 114.385 176.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 11.9 tppt? -71.12 -46.0 62.53 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.663 1.185 . . . . 0.0 112.234 -177.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -103.31 145.34 30.1 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.22 1.808 . . . . 0.0 112.013 -175.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -74.2 73.68 1.78 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 122.993 0.517 . . . . 0.0 112.266 176.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 68.1 mt . . . . . 0 CA--C 1.548 0.886 0 C-N-CA 125.981 1.712 . . . . 0.0 114.757 170.509 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 35.9 t-80 . . . . . 0 CA--C 1.545 0.769 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 11.5 tp 66.43 140.1 0.06 OUTLIER Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 127.896 2.478 . . . . 0.0 112.674 -169.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -63.54 117.97 4.91 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 CA-C-N 120.49 1.211 . . . . 0.0 109.076 162.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.6 p -123.33 137.3 54.87 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 121.604 0.716 . . . . 0.0 112.795 -178.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.1 m -119.3 49.31 1.36 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.557 1.943 . . . . 0.0 109.593 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -132.22 167.17 20.28 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.681 1.192 . . . . 0.0 111.166 -171.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 54.3 mtp85 -57.67 0.25 0.06 Allowed 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 118.194 2.664 . . . . 0.0 118.194 -169.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 56.46 37.65 75.94 Favored Glycine 0 N--CA 1.477 1.37 0 CA-C-N 120.159 1.345 . . . . 0.0 115.824 163.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 t -157.24 -177.81 6.89 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.389 1.475 . . . . 0.0 111.911 -169.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 80.2 p -64.46 145.38 56.18 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.516 1.527 . . . . 0.0 113.55 177.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 34.2 m -82.2 154.02 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 123.34 0.656 . . . . 0.0 112.244 167.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -73.86 64.0 0.94 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.13 2.172 . . . . 0.0 111.998 173.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -117.95 91.61 0.53 Allowed Glycine 0 CA--C 1.533 1.166 0 C-N-CA 125.658 1.599 . . . . 0.0 112.393 175.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.3 t -134.78 16.89 3.57 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 127.926 2.49 . . . . 0.0 113.864 -176.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 7.4 p90 -51.48 170.27 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 129.388 3.075 . . . . 0.0 115.517 176.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.6 p -107.52 162.89 13.53 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.449 1.5 . . . . 0.0 113.82 173.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 23.6 t -130.07 135.88 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.106 1.762 . . . . 0.0 109.728 -173.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -80.2 174.77 11.26 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.445 1.498 . . . . 0.0 112.406 177.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.52 -13.31 1.47 Allowed 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 116.279 1.955 . . . . 0.0 116.279 -172.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 9.4 m -151.7 54.54 0.84 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.12 1.768 . . . . 0.0 111.027 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.0 -120.8 5.4 Favored Glycine 0 CA--C 1.527 0.795 0 O-C-N 121.191 -0.943 . . . . 0.0 111.049 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 55.1 -178.81 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.107 0 CA-C-N 118.067 0.933 . . . . 0.0 112.329 -168.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -108.82 123.4 48.99 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.555 -1.341 . . . . 0.0 108.098 166.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.8 mt -87.08 147.79 25.53 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 120.253 1.388 . . . . 0.0 111.06 173.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 42.5 mm -67.67 95.93 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.495 1.118 . . . . 0.0 110.932 -176.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.7 p -136.2 142.78 44.13 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.085 1.354 . . . . 0.0 110.804 173.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 31.5 ttm180 -68.52 13.13 0.1 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.331 1.452 . . . . 0.0 114.805 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -62.88 -63.44 1.21 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.529 1.531 . . . . 0.0 112.495 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 45.7 pt -55.53 -26.88 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 126.236 1.814 . . . . 0.0 115.644 -169.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -65.79 -33.33 75.61 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.932 -1.105 . . . . 0.0 112.53 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -71.5 -35.44 70.77 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.527 0.731 . . . . 0.0 110.422 178.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tt -63.99 -49.46 72.4 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.059 1.344 . . . . 0.0 110.595 175.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -58.04 -46.83 84.71 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.047 -0.978 . . . . 0.0 113.154 170.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -64.43 -37.94 89.27 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 120.96 1.709 . . . . 0.0 112.148 -178.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.48 -41.51 89.93 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.473 -0.767 . . . . 0.0 112.361 176.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -89.26 -13.55 37.88 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 67.3 mt -74.64 -35.78 62.87 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.613 1.097 . . . . 0.0 111.455 163.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.9 t -67.53 -48.16 67.8 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.798 0.839 . . . . 0.0 111.39 170.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -93.02 30.33 1.64 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.739 1.216 . . . . 0.0 113.608 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.3 p -67.03 -26.8 37.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 -171.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 125.29 126.02 2.97 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 125.484 1.516 . . . . 0.0 113.884 171.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -67.83 -23.23 65.15 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.797 1.239 . . . . 0.0 113.717 173.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -154.52 -58.25 0.02 OUTLIER Pre-proline 0 CA--C 1.553 1.081 0 C-N-CA 126.449 1.899 . . . . 0.0 113.724 174.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -77.41 59.94 6.86 Favored 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 124.218 3.279 . . . . 0.0 114.392 -172.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.24 -25.36 61.6 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 126.294 1.838 . . . . 0.0 113.724 -174.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.42 -25.69 68.12 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 120.721 -1.237 . . . . 0.0 114.198 177.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -92.03 -34.99 14.19 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.561 1.073 . . . . 0.0 113.442 -174.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 66.2 p -61.24 -44.98 96.37 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.681 -0.637 . . . . 0.0 110.749 175.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -36.21 83.6 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.271 0.628 . . . . 0.0 112.089 176.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -63.43 -44.31 94.96 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.412 0.685 . . . . 0.0 111.442 -176.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -72.88 -42.39 63.7 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.496 0.718 . . . . 0.0 111.642 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.435 ' O ' HD12 ' A' ' 120' ' ' ILE . 57.3 tp -51.45 -59.93 3.7 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.909 0.883 . . . . 0.0 111.875 174.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.7 ppt_? -64.57 -20.95 66.55 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.03 -1.044 . . . . 0.0 113.526 -177.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -74.47 -45.84 43.5 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 124.123 0.889 . . . . 0.0 112.181 169.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -57.43 -50.9 71.53 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 118.962 0.801 . . . . 0.0 112.284 177.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.435 HD12 ' O ' ' A' ' 116' ' ' LEU . 4.0 mp -59.79 -41.78 86.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 119.587 1.085 . . . . 0.0 111.598 177.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.07 -32.8 73.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.41 33.06 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.179 -0.951 . . . . 0.0 110.645 175.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -71.61 -53.23 14.34 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.257 0.623 . . . . 0.0 112.303 -174.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.1 mt -81.1 166.54 20.61 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.162 0.506 . . . . 0.0 111.566 174.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -85.12 -87.46 0.12 Allowed 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -165.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.427 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 20.8 tt0 -143.02 -62.83 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.127 1.371 . . . . 0.0 109.782 169.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.427 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 63.2 Cg_endo -64.54 -37.23 39.03 Favored 'Trans proline' 0 C--N 1.356 0.926 0 CA-C-N 121.993 1.748 . . . . 0.0 112.27 177.063 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.04 -38.37 65.14 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.028 -1.045 . . . . 0.0 112.529 172.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.56 -49.27 78.42 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.959 1.704 . . . . 0.0 110.557 176.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.8 -32.83 70.83 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 126.771 2.129 . . . . 0.0 114.32 175.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -78.26 -30.59 48.68 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.721 1.26 . . . . 0.0 110.909 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.76 -46.44 62.94 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.841 0.746 . . . . 0.0 111.306 -177.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.8 pp -64.9 -39.36 93.41 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.755 0.422 . . . . 0.0 111.898 174.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.62 -52.69 62.35 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.654 -0.654 . . . . 0.0 112.308 175.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.5 -29.45 69.09 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 117.877 -1.058 . . . . 0.0 111.817 176.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 46.3 ttp -66.65 -50.91 61.42 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.475 1.034 . . . . 0.0 111.771 174.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -67.68 -38.78 84.19 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.301 -0.874 . . . . 0.0 112.127 178.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.18 -41.21 94.84 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.988 1.315 . . . . 0.0 112.016 176.063 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -59.71 -37.51 79.08 Favored 'General case' 0 N--CA 1.465 0.314 0 O-C-N 121.331 -0.856 . . . . 0.0 111.503 172.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 84.1 mt -72.79 -40.98 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 123.834 0.854 . . . . 0.0 112.004 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -57.79 -51.12 70.88 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.528 1.131 . . . . 0.0 111.289 170.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 7.5 m-30 -89.13 11.38 18.75 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.384 1.074 . . . . 0.0 113.289 -176.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -65.29 -30.29 71.13 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.355 1.062 . . . . 0.0 112.358 178.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 36.2 pttt -159.03 150.11 20.14 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.247 1.819 . . . . 0.0 112.302 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -73.89 61.32 0.78 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.706 1.202 . . . . 0.0 111.478 168.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 7.0 mp . . . . . 0 CA--C 1.545 0.761 0 C-N-CA 128.961 2.904 . . . . 0.0 114.19 -170.005 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 23.5 m170 . . . . . 0 CA--C 1.544 0.742 0 CA-C-O 121.306 0.574 . . . . 0.0 111.717 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.57 87.35 3.39 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 124.359 1.064 . . . . 0.0 111.83 -179.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -74.53 -172.09 1.1 Allowed 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 123.96 3.107 . . . . 0.0 112.112 166.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 82.7 p -63.51 174.04 1.44 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 128.069 2.547 . . . . 0.0 116.069 -169.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.4 t 66.77 37.62 4.12 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 126.616 1.966 . . . . 0.0 115.197 -177.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 20.5 p90 -122.45 160.72 24.94 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.837 1.655 . . . . 0.0 111.557 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -165.51 162.56 19.3 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 127.041 2.136 . . . . 0.0 109.726 172.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -164.13 167.94 38.35 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 123.947 0.784 . . . . 0.0 112.999 -178.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 75.8 p -110.5 48.14 0.93 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.904 1.282 . . . . 0.0 112.963 -168.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.8 t 53.66 41.95 31.96 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.375 1.47 . . . . 0.0 114.315 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 24.0 m -89.91 172.67 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 125.492 1.517 . . . . 0.0 112.567 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -160.7 134.62 7.0 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.73 2.012 . . . . 0.0 107.489 171.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.91 76.66 0.07 OUTLIER Glycine 0 CA--C 1.53 1.017 0 C-N-CA 126.213 1.863 . . . . 0.0 113.427 172.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 7.6 t -75.92 27.61 0.11 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.892 1.677 . . . . 0.0 113.846 176.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -65.47 164.6 13.59 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.61 1.564 . . . . 0.0 112.205 177.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.7 p -120.36 156.15 31.93 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.702 1.201 . . . . 0.0 112.517 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 22.4 t -121.62 128.85 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 125.77 1.628 . . . . 0.0 108.624 -173.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -76.61 179.84 5.73 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.291 1.036 . . . . 0.0 112.636 176.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.73 -29.25 17.78 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 -168.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.3 m -143.55 84.85 1.82 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.654 1.582 . . . . 0.0 109.22 169.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 67.15 -124.3 22.63 Favored Glycine 0 CA--C 1.533 1.199 0 O-C-N 122.07 -0.394 . . . . 0.0 113.086 -177.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 57.31 178.92 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.858 1.263 . . . . 0.0 113.235 -168.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -113.05 125.76 54.74 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 164.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.6 mt -85.7 158.56 20.02 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 118.848 0.749 . . . . 0.0 110.228 169.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 39.8 mm -69.77 119.81 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.421 0.688 . . . . 0.0 110.437 179.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.7 p -147.46 162.16 39.6 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.733 0.813 . . . . 0.0 111.383 177.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -92.05 -19.79 21.98 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.922 -0.486 . . . . 0.0 111.815 -175.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.6 -29.5 37.98 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 173.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.0 mm -55.05 -34.93 33.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 O-C-N 120.794 -1.191 . . . . 0.0 111.433 -177.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -84.77 -18.67 34.33 Favored 'General case' 0 C--N 1.339 0.149 0 O-C-N 121.171 -0.956 . . . . 0.0 111.613 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -73.77 -30.04 62.54 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.208 0.603 . . . . 0.0 110.501 173.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.8 mp -66.54 -57.01 8.18 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.428 0.558 . . . . 0.0 110.853 171.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -53.66 -46.55 70.63 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.346 177.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -60.66 -40.31 91.59 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.517 1.053 . . . . 0.0 112.715 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.41 -46.29 87.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.139 -0.975 . . . . 0.0 112.333 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -78.78 -21.12 48.3 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.0 mt -69.05 -37.1 78.37 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 119.439 1.018 . . . . 0.0 112.574 171.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.0 t -71.57 -37.21 71.06 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 119.152 0.887 . . . . 0.0 112.154 171.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -81.9 2.92 28.25 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 177.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 9.9 p -60.7 -29.45 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 116.265 1.95 . . . . 0.0 116.265 -155.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 102.54 171.15 26.81 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 124.501 1.048 . . . . 0.0 114.797 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -147.2 -58.28 0.27 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.417 1.487 . . . . 0.0 110.745 -176.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -80.52 -62.97 0.36 Allowed Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 123.527 0.731 . . . . 0.0 111.814 167.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -74.88 141.34 26.89 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.676 2.251 . . . . 0.0 110.348 168.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -141.06 -41.56 0.39 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.629 1.171 . . . . 0.0 110.356 177.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -54.63 -40.33 68.84 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.695 1.198 . . . . 0.0 112.769 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 28.6 mp0 -72.16 -43.4 64.68 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.002 -1.061 . . . . 0.0 113.048 178.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 28.0 t -54.77 -49.65 70.38 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.853 0.861 . . . . 0.0 110.614 175.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.97 -37.58 72.78 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 117.578 -1.201 . . . . 0.0 112.752 178.035 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -57.96 -51.07 71.17 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 120.125 1.329 . . . . 0.0 110.633 178.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -72.77 -37.6 67.57 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 117.998 -1.001 . . . . 0.0 111.577 -176.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 52.3 tp -54.98 -63.67 1.08 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.524 0.73 . . . . 0.0 111.558 173.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.76 -22.28 66.83 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 117.523 -1.227 . . . . 0.0 113.427 -177.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.92 -44.71 54.23 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 124.21 0.944 . . . . 0.0 112.287 168.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -53.17 -50.53 64.4 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.75 1.22 . . . . 0.0 112.315 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.0 mp -60.72 -39.37 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 O-C-N 121.63 -0.669 . . . . 0.0 111.955 177.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -75.2 -15.95 60.52 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -98.57 -35.39 10.23 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.127 1.371 . . . . 0.0 113.296 175.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -82.91 -39.41 21.53 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.917 0.887 . . . . 0.0 112.214 175.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 83.6 mt -93.95 168.32 11.04 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.387 1.089 . . . . 0.0 112.285 168.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.9 -91.35 0.09 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.63 1.172 . . . . 0.0 112.31 -164.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.444 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 19.5 tt0 -146.07 -55.12 0.02 OUTLIER Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.932 1.293 . . . . 0.0 111.281 173.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.444 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 57.6 Cg_endo -68.34 -43.32 4.49 Favored 'Trans proline' 0 C--N 1.356 0.949 0 CA-C-N 121.921 1.722 . . . . 0.0 111.726 173.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -48.92 -39.47 26.27 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.648 1.579 . . . . 0.0 113.142 173.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.87 -45.13 95.79 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.183 1.393 . . . . 0.0 111.355 176.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.95 -35.17 82.11 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 125.485 1.517 . . . . 0.0 113.707 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -73.73 -32.92 64.1 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.362 1.081 . . . . 0.0 110.68 174.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.09 -45.0 62.35 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.173 0.589 . . . . 0.0 111.565 -176.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -68.07 -37.06 80.84 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.338 0.655 . . . . 0.0 112.259 175.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.9 -51.51 66.67 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.304 0.502 . . . . 0.0 112.012 173.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.7 mp -58.37 -30.1 66.52 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 117.874 -1.06 . . . . 0.0 111.646 175.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.432 ' SD ' HD11 ' A' ' 140' ' ' ILE . 0.0 OUTLIER -63.78 -57.36 10.17 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.067 0.848 . . . . 0.0 111.483 175.682 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.72 -37.24 84.29 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.215 -0.928 . . . . 0.0 112.395 179.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.8 -38.95 92.71 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.189 1.396 . . . . 0.0 112.203 173.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -65.32 -43.19 91.81 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.368 -0.832 . . . . 0.0 111.27 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 136' ' ' MET . 55.6 mt -62.43 -38.76 82.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-O 118.406 -0.807 . . . . 0.0 112.419 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -57.2 -23.05 45.17 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.963 0.905 . . . . 0.0 112.786 175.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -118.1 6.6 12.08 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.381 1.472 . . . . 0.0 114.455 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -79.61 -17.41 53.91 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.64 1.176 . . . . 0.0 113.857 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -96.95 137.07 36.6 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.987 1.315 . . . . 0.0 109.545 173.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -73.45 91.24 1.76 Allowed 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.419 -0.801 . . . . 0.0 110.946 177.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 9.3 mp . . . . . 0 N--CA 1.477 0.884 0 C-N-CA 128.484 2.713 . . . . 0.0 116.898 169.872 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 . . . . . 0 CA--C 1.556 1.182 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 25.6 tp -128.59 74.52 80.24 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 125.878 1.671 . . . . 0.0 112.096 -168.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -80.68 -31.15 1.58 Allowed 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 123.114 2.543 . . . . 0.0 113.578 178.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 22.2 p -92.66 116.44 29.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.987 1.315 . . . . 0.0 112.133 -173.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.6 m -136.94 154.69 50.38 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.147 1.779 . . . . 0.0 111.349 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -59.95 109.8 1.03 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.442 1.097 . . . . 0.0 113.207 -172.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 55.48 22.48 5.1 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 125.585 1.554 . . . . 0.0 113.005 -174.038 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 107.46 -164.3 13.05 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 125.175 1.369 . . . . 0.0 112.986 -173.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.5 p -91.33 17.66 8.12 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.835 1.654 . . . . 0.0 114.208 -175.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.5 m -77.23 54.25 1.08 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 126.235 1.814 . . . . 0.0 115.507 -170.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 27.3 m -93.85 144.3 9.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 124.432 1.093 . . . . 0.0 111.751 171.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -67.12 -43.18 83.1 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 121.443 -0.786 . . . . 0.0 112.449 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.17 39.76 81.91 Favored Glycine 0 N--CA 1.475 1.236 0 C-N-CA 124.969 1.271 . . . . 0.0 114.356 171.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.4 t -139.72 55.53 1.66 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.785 1.279 . . . . 0.0 109.71 -152.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 8.1 p90 -95.6 161.19 14.15 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 127.399 2.279 . . . . 0.0 112.228 177.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 p -92.23 155.35 18.04 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.597 1.559 . . . . 0.0 113.259 171.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 27.7 m -131.75 159.48 43.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 125.998 1.719 . . . . 0.0 110.438 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -91.35 -178.95 5.27 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.043 1.737 . . . . 0.0 112.715 -177.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.72 15.62 0.1 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.113 1.765 . . . . 0.0 115.528 -173.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.5 m -160.49 38.93 0.17 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.966 2.107 . . . . 0.0 110.547 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 74.69 -122.51 7.16 Favored Glycine 0 CA--C 1.529 0.961 0 O-C-N 121.035 -1.041 . . . . 0.0 110.981 -166.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 57.07 -174.9 0.07 Allowed 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 118.182 0.991 . . . . 0.0 112.996 -171.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 87' ' ' LEU . 4.2 mt -108.58 134.56 51.17 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.942 0.897 . . . . 0.0 108.985 171.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.7 164.3 12.64 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.715 0.806 . . . . 0.0 111.374 175.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 39.3 mm -66.43 108.86 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.025 0.93 . . . . 0.0 111.231 175.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 10.1 t -155.93 162.96 40.31 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.838 1.255 . . . . 0.0 111.675 170.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -94.26 9.09 39.42 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -57.03 -46.14 82.62 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 121.156 -0.965 . . . . 0.0 111.981 172.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.5 pt -56.46 -33.33 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.519 1.128 . . . . 0.0 113.622 178.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 40.0 ttt85 -61.33 -45.1 95.84 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 118.696 0.68 . . . . 0.0 110.706 173.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -68.01 -33.4 74.55 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.153 0.581 . . . . 0.0 111.334 -178.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 6.3 mp -62.82 -52.56 62.68 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.843 0.747 . . . . 0.0 112.017 168.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.71 -42.9 98.16 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.306 0.957 . . . . 0.0 112.749 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -62.94 -43.88 97.6 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.526 1.057 . . . . 0.0 111.717 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.81 -36.72 79.78 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -90.2 -24.77 20.91 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 31.6 mt -63.59 -44.63 93.46 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 119.308 0.958 . . . . 0.0 111.544 173.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.9 t -72.95 -26.41 61.37 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.65 -11.8 61.13 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 115.887 1.81 . . . . 0.0 115.887 -177.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 8.0 p -67.46 -38.97 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 119.793 1.178 . . . . 0.0 114.062 -172.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 56.01 -132.96 50.84 Favored Glycine 0 CA--C 1.538 1.514 0 O-C-N 121.702 -0.624 . . . . 0.0 112.803 -174.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -105.89 -2.35 23.09 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 124.725 1.21 . . . . 0.0 113.687 172.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -70.71 153.43 94.9 Favored Pre-proline 0 CA--C 1.543 0.673 0 C-N-CA 125.096 1.358 . . . . 0.0 111.536 178.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -64.57 115.75 3.39 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 121.851 1.701 . . . . 0.0 112.08 -173.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.1 tt -50.97 -28.59 10.18 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.43 1.892 . . . . 0.0 112.483 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -48.33 -29.63 4.12 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.701 1.6 . . . . 0.0 113.979 171.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -89.64 -40.18 12.74 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 176.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 89.1 p -68.05 -37.12 80.95 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 121.289 -0.882 . . . . 0.0 111.506 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.5 pp -65.09 -34.17 77.77 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 118.996 -0.526 . . . . 0.0 111.886 173.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -64.92 -45.39 86.04 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.265 0.555 . . . . 0.0 111.816 -175.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 18.3 mmt85 -64.2 -43.62 94.46 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.112 0.565 . . . . 0.0 110.721 171.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.452 ' O ' HD12 ' A' ' 120' ' ' ILE . 54.8 tp -56.1 -56.16 24.18 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.434 0.694 . . . . 0.0 112.153 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -55.77 -37.01 67.98 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 119.256 0.935 . . . . 0.0 112.285 179.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.71 -41.35 92.41 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.807 0.843 . . . . 0.0 112.431 178.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -61.58 -49.04 78.26 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 118.558 -0.734 . . . . 0.0 111.958 173.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.452 HD12 ' O ' ' A' ' 116' ' ' LEU . 3.5 mp -57.94 -45.81 87.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.794 1.179 . . . . 0.0 111.195 175.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.84 -32.96 74.9 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -80.64 -45.77 16.7 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.997 0.817 . . . . 0.0 112.708 177.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -66.0 -51.87 54.44 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.993 1.317 . . . . 0.0 112.985 -178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.508 HD12 ' HB1' ' A' ' 128' ' ' ALA . 3.7 mm? -75.9 -160.92 0.15 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.836 1.255 . . . . 0.0 112.102 -178.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.54 -105.48 0.39 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.08 1.352 . . . . 0.0 109.239 173.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.405 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 56.7 tt0 -127.54 -64.38 0.02 OUTLIER Pre-proline 0 N--CA 1.468 0.464 0 O-C-N 120.126 -1.609 . . . . 0.0 110.162 -176.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.405 ' HD2' ' H ' ' A' ' 126' ' ' GLU . 77.6 Cg_endo -67.08 -30.95 37.8 Favored 'Trans proline' 0 C--N 1.349 0.574 0 CA-C-N 121.206 1.467 . . . . 0.0 111.561 173.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.508 ' HB1' HD12 ' A' ' 124' ' ' LEU . . . -63.6 -35.41 80.41 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 120.794 -1.191 . . . . 0.0 112.267 172.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -64.55 -47.3 79.3 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.971 0.908 . . . . 0.0 110.125 170.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.8 -34.54 78.1 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.138 1.352 . . . . 0.0 114.008 177.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -33.15 64.84 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.812 1.306 . . . . 0.0 110.041 175.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -73.38 -43.42 60.62 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.372 0.669 . . . . 0.0 111.558 -174.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -69.49 -35.54 75.67 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.094 0.557 . . . . 0.0 112.439 174.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.84 -50.51 70.65 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 122.937 0.495 . . . . 0.0 111.923 172.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.7 mp -57.79 -31.98 67.1 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 117.619 -1.182 . . . . 0.0 111.916 173.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 2.3 tpt -64.53 -52.32 58.34 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.611 1.096 . . . . 0.0 111.137 174.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 38.3 mm-40 -62.4 -43.08 99.66 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.104 0.562 . . . . 0.0 112.46 177.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -41.82 86.23 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.64 1.176 . . . . 0.0 111.985 -179.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -60.88 -42.68 98.4 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.852 0.751 . . . . 0.0 111.332 170.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 68.3 mt -62.5 -28.74 45.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-O 119.182 -0.437 . . . . 0.0 111.089 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -76.9 -31.21 56.57 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.656 -176.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 8.3 p90 -102.55 3.31 37.28 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 174.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 9.9 ttpt -54.17 -29.24 44.86 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 125.465 1.506 . . . . 0.0 113.585 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.75 148.21 28.96 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.125 1.37 . . . . 0.0 112.546 169.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -74.6 39.2 0.12 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 124.906 1.282 . . . . 0.0 112.32 165.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 7.3 mp . . . . . 0 N--CA 1.475 0.793 0 C-N-CA 129.966 3.307 . . . . 0.0 115.553 -167.322 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 21.6 m80 . . . . . 0 CA--C 1.539 0.549 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 39.5 mt -141.01 63.31 18.25 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.12 1.368 . . . . 0.0 111.272 171.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -61.78 140.21 84.53 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 122.373 2.049 . . . . 0.0 111.36 175.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.4 p -75.64 18.52 0.23 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.58 1.952 . . . . 0.0 115.46 -164.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 73.9 m -71.66 85.15 0.89 Allowed 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.87 -1.144 . . . . 0.0 110.942 177.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -158.58 30.61 0.23 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.539 1.135 . . . . 0.0 113.004 -176.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.9 mmt85 59.48 -14.64 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 118.173 2.656 . . . . 0.0 118.173 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 126.8 109.74 1.63 Allowed Glycine 0 CA--C 1.53 1.018 0 C-N-CA 127.109 2.29 . . . . 0.0 110.765 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.1 p -60.02 -46.83 88.2 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -154.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.2 m 54.66 13.96 0.78 Allowed 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 16.7 m -64.35 151.58 9.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 126.521 1.928 . . . . 0.0 113.808 -171.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -77.22 -57.1 4.02 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 61.48 17.54 53.6 Favored Glycine 0 CA--C 1.541 1.718 0 C-N-CA 124.534 1.064 . . . . 0.0 115.73 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.6 t -79.83 28.74 0.27 Allowed 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.583 1.553 . . . . 0.0 114.308 -175.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -67.66 161.88 24.88 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.803 1.241 . . . . 0.0 112.788 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 73.4 p -147.52 163.17 37.41 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.958 0.903 . . . . 0.0 113.201 -178.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.8 p -127.99 130.2 69.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.675 1.59 . . . . 0.0 111.975 -167.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -82.75 178.9 7.96 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.653 1.581 . . . . 0.0 113.336 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.43 -7.01 0.2 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 127.483 2.313 . . . . 0.0 117.203 -173.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.3 m -161.53 75.84 0.5 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 126.041 1.736 . . . . 0.0 109.864 161.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 73.58 -127.3 10.47 Favored Glycine 0 CA--C 1.528 0.874 0 O-C-N 121.169 -0.957 . . . . 0.0 110.939 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 57.84 175.95 0.05 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.357 1.063 . . . . 0.0 111.372 -166.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.4 125.84 52.2 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.629 -1.294 . . . . 0.0 108.26 167.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.9 mt -84.29 166.33 17.56 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 118.925 0.784 . . . . 0.0 111.959 175.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 38.2 mm -73.49 94.96 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 124.583 1.153 . . . . 0.0 112.127 -173.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 46.3 p -138.03 148.05 44.74 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.933 1.693 . . . . 0.0 111.58 177.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.31 6.04 48.33 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -174.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -59.48 -39.01 82.37 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.979 0.912 . . . . 0.0 110.906 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 32.8 pt -55.53 -37.09 44.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 125.792 1.637 . . . . 0.0 113.356 176.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 -61.18 -55.22 34.73 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.238 1.015 . . . . 0.0 109.888 176.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -66.48 -31.81 72.78 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.534 0.733 . . . . 0.0 112.305 -179.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 8.7 mt -62.51 -53.4 55.26 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.165 0.986 . . . . 0.0 112.497 172.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -59.8 -46.24 89.83 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.68 0.673 . . . . 0.0 110.867 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -65.16 -34.17 77.74 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -177.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.02 -44.7 79.62 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.149 -0.97 . . . . 0.0 112.664 173.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -74.62 -31.22 61.93 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.495 -0.753 . . . . 0.0 112.293 179.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 60.0 mt -63.49 -39.84 95.5 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.814 0.734 . . . . 0.0 110.465 169.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 34.1 m -67.74 -3.17 8.51 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 172.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -112.46 0.5 15.58 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.794 1.638 . . . . 0.0 113.606 172.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.3 p -66.8 -11.8 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 -168.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -59.99 -68.26 1.76 Allowed Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.335 1.445 . . . . 0.0 113.434 -178.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -67.64 169.67 9.03 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 118.149 0.975 . . . . 0.0 111.396 172.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 57.37 153.44 0.08 OUTLIER Pre-proline 0 N--CA 1.49 1.553 0 C-N-CA 127.328 2.251 . . . . 0.0 117.0 -173.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -69.3 144.63 57.14 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 121.815 1.677 . . . . 0.0 110.534 163.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -49.12 -41.67 36.69 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.601 1.16 . . . . 0.0 112.662 -178.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -58.99 -29.96 67.61 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.74 1.216 . . . . 0.0 113.688 -178.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -85.04 -43.35 14.01 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.01 0.823 . . . . 0.0 111.968 178.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 48.1 t -59.72 -43.15 94.3 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 123.767 0.827 . . . . 0.0 111.343 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.3 pp -68.91 -35.46 76.86 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.605 -0.712 . . . . 0.0 112.307 174.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.78 -45.81 92.28 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.379 0.991 . . . . 0.0 110.637 178.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -57.63 -45.16 85.76 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.872 0.869 . . . . 0.0 111.642 174.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 38.7 tp -62.65 -56.57 16.56 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.515 0.726 . . . . 0.0 112.461 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -22.52 65.54 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.179 -0.951 . . . . 0.0 113.328 -177.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -72.64 -40.17 66.61 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.137 0.975 . . . . 0.0 113.126 174.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -42.9 74.06 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.647 0.658 . . . . 0.0 110.486 177.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 17.8 mt -57.06 -40.97 76.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 121.575 -0.703 . . . . 0.0 110.955 173.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.85 -23.15 64.2 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -79.34 -29.63 42.33 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 174.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -107.37 -37.5 6.21 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -170.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -88.51 156.72 18.93 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.291 1.436 . . . . 0.0 111.664 175.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -75.98 -69.03 0.52 Allowed 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 -157.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -165.21 -56.82 0.01 OUTLIER Pre-proline 0 N--CA 1.479 0.985 0 C-N-CA 127.147 2.179 . . . . 0.0 109.794 168.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -69.78 -39.69 6.16 Favored 'Trans proline' 0 C--N 1.356 0.927 0 CA-C-N 121.446 1.552 . . . . 0.0 111.498 173.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.34 -40.26 61.72 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.75 1.22 . . . . 0.0 112.35 175.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -60.23 -48.36 82.04 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.493 1.517 . . . . 0.0 111.163 174.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -58.52 -34.05 74.23 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.52 1.533 . . . . 0.0 113.625 177.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -73.83 -34.46 64.56 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 118.437 1.118 . . . . 0.0 110.906 175.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.78 -46.61 68.29 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 122.876 0.47 . . . . 0.0 110.902 -176.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 pp -71.08 -33.57 70.33 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 175.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.17 -53.02 59.82 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 118.826 0.739 . . . . 0.0 112.257 173.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.16 -34.22 70.06 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.673 0.789 . . . . 0.0 111.242 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 48.3 ttp -64.93 -52.93 53.68 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.601 0.761 . . . . 0.0 112.37 175.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -64.81 -37.64 88.3 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 121.587 -0.696 . . . . 0.0 112.428 178.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -43.35 94.85 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.344 1.058 . . . . 0.0 112.309 175.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . 0.437 ' O ' ' HE2' ' A' ' 143' ' ' LYS . 73.4 t80 -59.93 -39.47 85.6 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.44 -0.788 . . . . 0.0 111.465 175.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 88.3 mt -72.16 -41.87 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.079 1.351 . . . . 0.0 112.867 176.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -55.0 -53.24 58.26 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.134 1.374 . . . . 0.0 110.028 172.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -79.52 7.93 7.29 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 120.935 -1.103 . . . . 0.0 113.231 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.437 ' HE2' ' O ' ' A' ' 139' ' ' TYR . 0.0 OUTLIER -78.62 -29.63 46.03 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.093 0.957 . . . . 0.0 112.679 166.77 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -85.16 141.58 30.08 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.54 1.136 . . . . 0.0 112.373 178.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -98.11 13.76 29.93 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.564 1.546 . . . . 0.0 114.228 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 28.7 mt . . . . . 0 N--CA 1.482 1.151 0 C-N-CA 128.138 2.575 . . . . 0.0 116.444 179.713 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 . . . . . 0 CA--C 1.537 0.479 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -115.5 150.35 44.48 Favored Pre-proline 0 N--CA 1.476 0.856 0 C-N-CA 124.509 1.124 . . . . 0.0 111.958 -175.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -79.24 -10.21 15.01 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 122.903 2.402 . . . . 0.0 115.281 -173.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.1 t -127.25 156.1 42.42 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.85 1.26 . . . . 0.0 112.995 -167.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 77.2 p -90.34 -166.69 1.64 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.11 1.364 . . . . 0.0 113.422 -173.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -139.75 157.38 45.84 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.367 1.867 . . . . 0.0 109.635 178.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -82.44 151.08 26.72 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 172.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -76.1 49.61 2.58 Favored Glycine 0 CA--C 1.535 1.314 0 N-CA-C 116.085 1.194 . . . . 0.0 116.085 -171.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.1 t -88.57 139.65 30.26 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.928 1.291 . . . . 0.0 112.615 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.2 p -84.01 87.49 7.13 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.003 1.321 . . . . 0.0 111.681 179.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.4 131.46 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-O 121.418 0.628 . . . . 0.0 111.404 172.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -74.6 -47.16 33.94 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.664 1.585 . . . . 0.0 112.51 -178.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 65.65 35.32 90.93 Favored Glycine 0 CA--C 1.541 1.691 0 CA-C-O 118.461 -1.189 . . . . 0.0 113.308 -172.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.8 t -112.59 131.31 55.68 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.333 1.453 . . . . 0.0 113.385 -166.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 7.1 p90 -169.79 178.09 4.19 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.217 1.807 . . . . 0.0 110.4 -176.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 53.9 p -137.11 159.67 41.21 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.739 1.216 . . . . 0.0 112.644 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.0 p -128.33 130.92 69.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 126.52 1.928 . . . . 0.0 111.52 -169.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -77.95 170.03 17.28 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 126.203 1.801 . . . . 0.0 111.644 173.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.34 -1.79 0.15 Allowed 'General case' 0 CA--C 1.558 1.265 0 N-CA-C 117.071 2.248 . . . . 0.0 117.071 -173.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 18.0 m -147.38 39.42 0.99 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.534 1.933 . . . . 0.0 112.094 175.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 86.94 -121.15 5.69 Favored Glycine 0 C--N 1.342 0.913 0 N-CA-C 109.951 -1.259 . . . . 0.0 109.951 -173.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 57.37 175.47 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.091 0.956 . . . . 0.0 112.764 -166.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.44 120.55 42.21 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 164.503 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.0 mt -84.15 161.0 20.76 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.14 0.882 . . . . 0.0 110.922 170.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 17.9 mt -75.17 99.08 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 124.301 1.04 . . . . 0.0 110.888 -173.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 31.9 p -113.18 155.48 24.94 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.842 0.857 . . . . 0.0 110.595 162.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.521 ' O ' ' HG2' ' A' ' 94' ' ' ARG . 1.5 tpm_? -72.02 -33.08 67.76 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.206 -0.934 . . . . 0.0 111.469 173.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.557 ' HA ' HD22 ' A' ' 95' ' ' ASN . 3.3 m-20 -53.36 -34.55 58.02 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 127.198 2.199 . . . . 0.0 113.447 -167.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 55.3 mt -44.38 -35.97 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 126.424 1.89 . . . . 0.0 112.782 173.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 91' ' ' ARG . 19.9 ptt85 -79.9 -24.92 40.8 Favored 'General case' 0 C--N 1.339 0.137 0 O-C-N 121.494 -0.754 . . . . 0.0 111.829 -173.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.557 HD22 ' HA ' ' A' ' 92' ' ' ASP . 68.1 m-80 -73.61 -30.73 63.17 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.175 0.99 . . . . 0.0 110.019 175.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.4 -45.09 89.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.738 0.815 . . . . 0.0 111.425 172.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -60.99 -47.96 84.02 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 118.127 -0.94 . . . . 0.0 112.715 170.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.7 -41.67 97.9 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 120.355 1.434 . . . . 0.0 112.148 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.24 -22.68 63.33 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 177.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -106.31 -22.49 12.81 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.3 mt -64.05 -51.16 65.43 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.977 1.262 . . . . 0.0 109.833 171.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.8 m -71.21 8.34 1.02 Allowed 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 172.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -134.58 14.99 3.7 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.876 1.27 . . . . 0.0 113.716 176.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.492 HG13 ' H ' ' A' ' 106' ' ' GLU . 8.4 p -76.87 -25.02 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.372 1.069 . . . . 0.0 113.503 -178.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.8 -10.31 19.34 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 124.922 1.248 . . . . 0.0 115.874 -179.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.492 ' H ' HG13 ' A' ' 104' ' ' VAL . 27.0 mm-40 62.49 -24.51 0.05 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 128.596 2.758 . . . . 0.0 117.202 175.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -105.89 -43.59 0.15 Allowed Pre-proline 0 CA--C 1.561 1.381 0 C-N-CA 125.116 1.366 . . . . 0.0 114.629 169.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -84.01 67.99 6.81 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.186 3.257 . . . . 0.0 112.825 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.68 8.73 1.05 Allowed 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -174.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -94.72 -69.8 0.74 Allowed 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.219 -1.55 . . . . 0.0 112.089 -178.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -70.36 -19.04 63.07 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 120.136 -1.602 . . . . 0.0 114.201 -171.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.0 p -65.13 -44.18 89.5 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 124.378 1.071 . . . . 0.0 111.63 171.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.8 -36.87 67.66 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 118.45 0.568 . . . . 0.0 111.88 175.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -63.65 -42.95 98.06 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.413 0.551 . . . . 0.0 112.067 -169.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 38.8 ptt85 -73.5 -32.37 64.24 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 172.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 43.9 tp -65.23 -58.26 6.4 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.998 0.817 . . . . 0.0 111.013 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.85 -30.81 67.98 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.334 -0.854 . . . . 0.0 112.017 178.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.97 -44.05 81.47 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 122.89 0.476 . . . . 0.0 111.988 174.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -53.36 -56.4 17.03 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.341 1.057 . . . . 0.0 112.049 173.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.404 HD12 ' H ' ' A' ' 120' ' ' ILE . 4.2 mp -60.54 -41.03 86.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 O-C-N 121.637 -0.664 . . . . 0.0 111.562 177.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.18 -24.22 64.94 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.31 -33.2 16.19 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.96 0.904 . . . . 0.0 113.062 173.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.54 -48.84 14.43 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.397 1.479 . . . . 0.0 113.342 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -92.36 155.15 18.1 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.66 1.584 . . . . 0.0 111.049 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -76.42 -74.16 0.24 Allowed 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 114.967 -1.015 . . . . 0.0 113.47 -159.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -158.12 -58.43 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.704 0 C-N-CA 125.102 1.361 . . . . 0.0 110.377 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -70.16 -41.22 3.94 Favored 'Trans proline' 0 C--N 1.353 0.81 0 CA-C-N 121.047 1.41 . . . . 0.0 111.321 171.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.25 -37.47 67.26 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.926 1.29 . . . . 0.0 113.12 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 20.1 ttt-85 -56.59 -50.93 70.52 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.253 1.821 . . . . 0.0 111.104 172.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.72 -30.54 62.8 Favored Glycine 0 CA--C 1.529 0.942 0 C-N-CA 125.408 1.48 . . . . 0.0 114.376 177.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -80.77 -30.6 36.0 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.412 1.106 . . . . 0.0 111.598 173.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.55 -45.9 64.59 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.635 -0.666 . . . . 0.0 111.043 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -66.34 -34.46 78.03 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.253 0.621 . . . . 0.0 112.638 174.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.0 -54.38 35.26 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.123 0.569 . . . . 0.0 112.124 173.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 65.7 mt -55.31 -38.17 68.34 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.673 0.789 . . . . 0.0 111.051 178.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 60.1 ttp -63.43 -53.79 46.68 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.068 0.947 . . . . 0.0 112.014 177.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -69.71 -32.24 70.71 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 121.009 -1.057 . . . . 0.0 113.258 -178.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -45.13 95.43 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.679 1.192 . . . . 0.0 110.932 169.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -61.81 -45.08 95.4 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.155 -0.965 . . . . 0.0 111.639 174.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 71.1 mt -61.66 -38.41 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.173 0.989 . . . . 0.0 112.076 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -58.11 -54.74 43.49 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.373 1.469 . . . . 0.0 111.471 173.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -86.01 1.23 51.03 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 120.122 -1.611 . . . . 0.0 113.04 -174.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -54.7 -50.67 67.74 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.22 1.008 . . . . 0.0 110.424 173.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -59.99 161.49 6.63 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.105 1.362 . . . . 0.0 112.946 175.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.85 86.59 2.49 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.812 0.815 . . . . 0.0 112.212 -176.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 41.5 mt . . . . . 0 N--CA 1.48 1.035 0 C-N-CA 127.083 2.153 . . . . 0.0 116.649 174.056 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 33.2 m170 . . . . . 0 CA--C 1.544 0.75 0 CA-C-O 120.497 0.189 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 mp 64.5 160.29 0.12 Allowed Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 127.984 2.514 . . . . 0.0 115.955 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -78.42 -45.38 0.13 Allowed 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 123.022 2.482 . . . . 0.0 113.192 178.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.6 p -154.43 151.05 28.54 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 127.185 2.194 . . . . 0.0 109.811 178.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.8 t -79.37 -177.97 6.01 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 122.933 0.493 . . . . 0.0 111.382 169.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -81.28 172.49 13.54 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.321 1.048 . . . . 0.0 113.264 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 71' ' ' ARG . 21.3 ttt180 -125.75 154.72 42.1 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.294 176.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 89.33 -164.0 31.74 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 115.968 -0.56 . . . . 0.0 113.684 -173.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.1 t -142.82 -4.55 0.94 Allowed 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.8 m -82.9 58.3 4.28 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.936 1.694 . . . . 0.0 113.393 -170.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 23.0 m -111.16 160.48 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 124.797 1.239 . . . . 0.0 111.62 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -106.62 -69.36 0.84 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 68.17 0.15 14.35 Favored Glycine 0 CA--C 1.539 1.564 0 N-CA-C 117.625 1.81 . . . . 0.0 117.625 168.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.3 t -117.4 51.54 1.02 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.485 1.642 . . . . 0.0 112.34 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -68.71 168.64 12.81 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.039 1.336 . . . . 0.0 114.205 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.1 p -84.68 162.59 19.64 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.369 1.468 . . . . 0.0 114.032 176.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.3 p -145.28 140.63 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 125.254 1.422 . . . . 0.0 111.122 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -80.96 174.65 11.41 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.459 1.904 . . . . 0.0 111.881 175.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.94 -6.94 0.64 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.71 2.004 . . . . 0.0 115.791 -177.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 26.9 m -156.87 59.34 0.53 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.56 1.944 . . . . 0.0 110.758 169.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.11 -115.98 4.22 Favored Glycine 0 C--N 1.341 0.85 0 O-C-N 121.18 -0.95 . . . . 0.0 111.482 178.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.426 ' O ' ' HB2' ' A' ' 128' ' ' ALA . 28.5 m-20 52.36 -177.03 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.748 1.619 . . . . 0.0 113.006 -174.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 87' ' ' LEU . 1.4 mt -114.6 119.46 36.84 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 120.342 -1.474 . . . . 0.0 109.777 167.32 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.8 mt -85.04 149.19 25.75 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.632 0.773 . . . . 0.0 110.246 172.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 15.0 mt -81.77 112.45 19.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 123.525 0.73 . . . . 0.0 110.137 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 6.4 t -155.0 176.51 12.44 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.3 1.04 . . . . 0.0 112.202 169.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -68.31 -15.15 63.46 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -165.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -63.17 -32.41 73.79 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.751 1.159 . . . . 0.0 112.234 -177.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.7 mt -63.51 -36.47 76.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.384 0.673 . . . . 0.0 111.743 -170.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -59.67 -52.02 67.29 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 121.619 -0.676 . . . . 0.0 110.494 170.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -62.43 -30.63 71.37 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.32 1.048 . . . . 0.0 112.296 -179.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.94 -53.51 56.39 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.087 0.955 . . . . 0.0 111.759 174.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -65.62 -43.23 90.19 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.373 176.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -40.06 89.7 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.338 0.972 . . . . 0.0 112.167 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.92 -38.18 84.86 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.51 -0.744 . . . . 0.0 112.586 -178.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -93.28 -21.11 19.79 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 32.1 mt -66.35 -23.35 66.33 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.58 1.082 . . . . 0.0 113.489 173.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 41.6 t -76.36 -39.71 53.12 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 121.719 -0.613 . . . . 0.0 112.44 164.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -77.1 33.39 0.15 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.546 1.938 . . . . 0.0 114.416 -176.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 3.0 p -135.86 1.56 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 126.398 1.879 . . . . 0.0 113.618 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -85.55 -59.56 1.9 Allowed Glycine 0 CA--C 1.531 1.082 0 O-C-N 121.074 -1.016 . . . . 0.0 113.132 173.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -82.67 -18.69 40.13 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -179.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.11 142.69 25.57 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 125.902 1.681 . . . . 0.0 110.713 175.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -68.41 150.5 75.82 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 122.072 1.848 . . . . 0.0 113.099 178.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.87 -45.36 40.86 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.516 1.927 . . . . 0.0 111.896 -178.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 12.5 tp-100 -57.47 -33.34 67.88 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.934 1.294 . . . . 0.0 113.924 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -86.53 -42.02 13.87 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 119.26 0.936 . . . . 0.0 112.57 174.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 20.7 t -56.26 -45.58 80.02 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 123.655 0.597 . . . . 0.0 111.322 179.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.55 -37.11 85.76 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 176.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -64.38 -48.47 75.34 Favored 'General case' 0 C--N 1.34 0.196 0 C-N-CA 123.31 0.644 . . . . 0.0 110.43 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -65.97 -37.45 86.02 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.625 174.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.5 tt -60.74 -65.03 0.75 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.377 0.989 . . . . 0.0 111.018 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.85 -27.61 69.29 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.42 1.088 . . . . 0.0 112.896 -176.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -75.25 -40.27 59.08 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -41.81 95.62 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 174.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 7.4 mt -62.08 -40.39 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.466 -0.771 . . . . 0.0 112.104 172.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.89 -28.0 64.22 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -77.84 -26.29 49.31 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.115 0.966 . . . . 0.0 113.55 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -107.71 -52.88 2.7 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.123 1.369 . . . . 0.0 114.176 -172.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -82.95 130.99 35.2 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.582 -1.324 . . . . 0.0 110.347 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -59.61 -77.27 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 114.287 -1.324 . . . . 0.0 112.881 -158.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -155.47 -61.27 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 125.021 1.328 . . . . 0.0 110.23 174.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -68.52 -37.67 12.51 Favored 'Trans proline' 0 C--N 1.352 0.752 0 CA-C-N 121.501 1.572 . . . . 0.0 110.485 172.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 86' ' ' ASN . . . -52.56 -44.29 65.77 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.145 0.978 . . . . 0.0 111.445 171.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -60.5 -51.47 69.31 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.608 1.963 . . . . 0.0 111.309 178.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -60.69 -30.1 71.58 Favored Glycine 0 CA--C 1.526 0.778 0 C-N-CA 125.387 1.47 . . . . 0.0 114.02 177.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -77.29 -33.7 55.72 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.565 1.183 . . . . 0.0 111.09 172.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.99 -46.15 68.79 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.343 -0.848 . . . . 0.0 111.045 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -69.04 -34.13 74.71 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 176.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.45 -53.16 56.46 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.251 0.621 . . . . 0.0 111.901 172.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.4 mt -55.57 -34.35 64.69 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.074 0.949 . . . . 0.0 111.413 175.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 36.9 ttp -65.86 -53.41 40.19 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 118.634 0.652 . . . . 0.0 112.12 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -59.72 -44.73 93.6 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 121.701 -0.624 . . . . 0.0 112.56 176.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -45.22 94.32 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.45 1.1 . . . . 0.0 111.389 178.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -58.62 -46.32 87.3 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.886 -0.509 . . . . 0.0 111.3 174.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 68.3 mt -61.76 -46.79 95.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 123.741 0.816 . . . . 0.0 111.32 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -65.62 -34.4 78.14 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.948 1.299 . . . . 0.0 112.252 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -91.75 -3.77 55.8 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 176.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -60.3 -43.49 96.24 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 120.995 -1.066 . . . . 0.0 113.115 -171.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.41 148.81 16.67 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.258 1.823 . . . . 0.0 113.098 178.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -135.69 85.06 2.13 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.071 0.948 . . . . 0.0 111.703 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 38.1 mt . . . . . 0 N--CA 1.48 1.047 0 C-N-CA 127.983 2.513 . . . . 0.0 117.261 176.171 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 . . . . . 0 CA--C 1.541 0.608 0 CA-C-O 120.467 0.175 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.651 ' HG ' HH21 ' A' ' 115' ' ' ARG . 18.3 tp 45.4 57.8 15.36 Favored Pre-proline 0 CA--C 1.557 1.22 0 C-N-CA 128.099 2.56 . . . . 0.0 115.415 170.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -64.37 164.61 22.56 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.741 2.961 . . . . 0.0 115.266 -172.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 73.3 p -90.96 88.36 6.99 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 126.496 1.918 . . . . 0.0 112.017 -174.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.0 m -68.95 34.8 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.383 1.473 . . . . 0.0 114.592 175.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -153.58 152.11 30.53 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.733 -1.229 . . . . 0.0 113.199 -169.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -55.58 -11.82 1.01 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 118.181 2.66 . . . . 0.0 118.181 -177.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 99.31 106.78 2.73 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 125.739 1.638 . . . . 0.0 111.664 -171.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.0 t -157.99 171.05 20.96 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 126.057 1.743 . . . . 0.0 110.863 -174.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 89.3 p -150.51 168.32 24.57 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.552 1.541 . . . . 0.0 112.294 -176.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 32.6 m -115.77 156.19 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 125.858 1.663 . . . . 0.0 110.259 176.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -50.93 -47.98 60.9 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -172.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 66.24 13.32 59.94 Favored Glycine 0 CA--C 1.538 1.472 0 N-CA-C 115.824 1.09 . . . . 0.0 115.824 174.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.0 t -106.82 29.71 6.76 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.433 1.493 . . . . 0.0 113.219 -171.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -64.28 158.92 22.05 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.954 1.702 . . . . 0.0 113.915 -175.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.3 p -116.42 165.48 13.17 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -170.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.4 p -140.32 131.84 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 126.702 2.001 . . . . 0.0 111.145 -165.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -81.92 174.21 11.49 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.17 0.988 . . . . 0.0 112.069 172.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.71 -7.95 0.34 Allowed 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 117.136 2.273 . . . . 0.0 117.136 -171.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.4 t -145.84 48.64 1.23 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.716 1.207 . . . . 0.0 111.729 171.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.58 -121.83 5.55 Favored Glycine 0 CA--C 1.528 0.856 0 O-C-N 120.626 -1.296 . . . . 0.0 110.463 -174.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 57.9 -176.69 0.07 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.169 0.988 . . . . 0.0 111.32 -168.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -115.03 119.84 37.84 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.055 -1.028 . . . . 0.0 108.432 170.116 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.2 mt -84.2 135.73 34.25 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 119.156 0.889 . . . . 0.0 110.46 174.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 24.4 mt -66.14 102.14 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 124.265 1.026 . . . . 0.0 109.899 -174.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.6 p -142.46 156.67 45.19 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.228 1.811 . . . . 0.0 110.689 -175.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 30.0 ttt180 -66.38 -21.66 66.23 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -159.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -51.65 -45.73 63.45 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.54 1.536 . . . . 0.0 113.281 -174.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 28.0 pt -60.32 -28.31 41.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -177.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.3 ttt85 -65.03 -48.42 73.92 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.056 0.844 . . . . 0.0 110.941 173.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -69.88 -33.88 72.82 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.651 0.38 . . . . 0.0 111.885 -179.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.7 mp -56.64 -54.42 46.2 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 118.29 0.496 . . . . 0.0 112.026 171.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -64.46 -39.11 93.2 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.89 -30.82 62.82 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.752 1.16 . . . . 0.0 112.909 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -65.03 -30.77 71.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 175.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -91.0 -12.43 35.88 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 175.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.9 mt -80.32 -38.89 29.74 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 171.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.6 m -74.9 134.24 41.64 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 178.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 61.0 23.65 13.8 Favored 'General case' 0 CA--C 1.554 1.115 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 175.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 9.4 p -54.14 -22.08 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.343 0 N-CA-C 116.8 2.148 . . . . 0.0 116.8 -169.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.69 -43.02 1.83 Allowed Glycine 0 CA--C 1.537 1.426 0 C-N-CA 125.81 1.671 . . . . 0.0 116.679 168.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -97.26 134.55 40.42 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.093 1.357 . . . . 0.0 110.764 168.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -61.19 -44.7 94.53 Favored Pre-proline 0 CA--C 1.548 0.874 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 173.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -82.81 117.29 2.61 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.489 2.126 . . . . 0.0 110.529 171.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.81 -10.9 1.88 Allowed 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 174.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -47.83 -35.07 9.59 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.648 1.579 . . . . 0.0 113.678 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -86.22 -46.44 10.36 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 63.6 p -69.55 -33.49 72.84 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 118.722 -0.656 . . . . 0.0 111.939 -176.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.1 pp -67.11 -31.54 72.08 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.377 0.671 . . . . 0.0 111.363 172.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -65.92 -42.65 89.85 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.312 0.96 . . . . 0.0 112.562 -172.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.651 HH21 ' HG ' ' A' ' 66' ' ' LEU . 0.7 OUTLIER -76.72 -20.26 56.75 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 119.766 -1.834 . . . . 0.0 111.879 175.099 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.28 -58.0 7.81 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.777 0.431 . . . . 0.0 110.404 171.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -63.42 -32.35 73.76 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 121.169 -0.957 . . . . 0.0 112.744 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.45 -43.29 94.72 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.924 0.89 . . . . 0.0 112.436 176.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.52 -42.01 87.93 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.54 -0.725 . . . . 0.0 110.883 174.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 18.1 mt -56.77 -42.18 76.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 O-C-N 121.715 -0.615 . . . . 0.0 111.483 172.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -66.9 -19.74 65.78 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -90.73 -9.03 48.19 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.163 1.385 . . . . 0.0 114.652 171.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -125.42 -37.64 2.35 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -173.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -91.22 143.56 26.53 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.854 1.661 . . . . 0.0 110.236 174.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -64.8 -76.09 0.08 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -155.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -158.12 -58.52 0.02 OUTLIER Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 125.197 1.399 . . . . 0.0 109.812 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.3 -41.09 5.19 Favored 'Trans proline' 0 C--N 1.356 0.925 0 CA-C-N 121.411 1.539 . . . . 0.0 111.241 169.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.06 -41.7 65.08 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 120.765 -1.209 . . . . 0.0 112.536 175.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -60.15 -49.66 76.76 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.566 1.546 . . . . 0.0 110.915 173.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.86 -34.26 70.88 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 125.001 1.286 . . . . 0.0 114.196 175.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.11 -33.38 65.53 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.901 1.35 . . . . 0.0 110.201 175.356 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -74.73 -43.16 56.44 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.298 -0.876 . . . . 0.0 111.811 -174.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 pp -68.36 -35.74 78.19 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 119.137 -0.458 . . . . 0.0 112.223 174.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.18 -50.21 74.06 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.643 0.656 . . . . 0.0 111.523 172.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.7 mp -56.39 -34.97 67.23 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.268 1.027 . . . . 0.0 112.149 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 3.3 tpt -65.09 -47.01 78.74 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.039 0.836 . . . . 0.0 111.74 177.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -67.06 -42.35 84.91 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.723 -0.611 . . . . 0.0 111.881 176.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -38.93 93.06 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.129 1.372 . . . . 0.0 112.371 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -63.81 -33.75 76.37 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.625 -1.297 . . . . 0.0 112.117 174.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 81.9 mt -77.04 -36.41 24.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.821 1.248 . . . . 0.0 111.589 175.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.599 ' O ' ' OD1' ' A' ' 141' ' ' ASP . 34.0 t0 -68.57 -30.28 69.02 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 120.869 -1.144 . . . . 0.0 110.365 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -96.99 10.03 40.35 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 173.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -68.24 -35.04 77.31 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 120.382 -1.449 . . . . 0.0 113.094 177.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -89.63 127.4 35.9 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.214 1.005 . . . . 0.0 111.945 176.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -77.95 66.93 3.7 Favored 'General case' 0 CA--C 1.548 0.874 0 O-C-N 121.326 -0.859 . . . . 0.0 111.632 173.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 82.5 mt . . . . . 0 CA--C 1.553 1.079 0 C-N-CA 126.258 1.823 . . . . 0.0 115.544 173.304 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 16.8 m80 . . . . . 0 CA--C 1.543 0.706 0 CA-C-O 120.733 0.302 . . . . 0.0 111.33 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 16.6 mt 51.91 72.58 1.16 Allowed Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 126.763 2.025 . . . . 0.0 113.578 -171.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -74.04 -40.38 1.34 Allowed 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 123.586 2.857 . . . . 0.0 113.998 -178.012 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.6 p -76.58 136.87 39.26 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.297 -0.877 . . . . 0.0 112.693 -170.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.1 p -149.17 164.63 34.19 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.656 0.782 . . . . 0.0 112.804 -178.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.401 ' CE1' ' HB2' ' A' ' 107' ' ' GLU . 14.0 m-85 -92.0 106.83 18.76 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 123.89 0.876 . . . . 0.0 108.996 176.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.63 102.11 3.21 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.625 1.17 . . . . 0.0 109.234 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -153.18 -71.36 0.01 OUTLIER Glycine 0 CA--C 1.526 0.733 0 C-N-CA 123.738 0.685 . . . . 0.0 111.548 -177.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.3 t -153.94 153.1 31.41 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.115 0.966 . . . . 0.0 111.554 177.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 59.0 m -89.16 135.91 33.31 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.41 1.084 . . . . 0.0 111.867 175.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 15.3 m -144.54 159.69 14.78 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.163 0 C-N-CA 125.493 1.517 . . . . 0.0 111.417 175.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -152.27 133.01 14.01 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.285 2.234 . . . . 0.0 107.329 176.227 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.722 ' HA2' ' OD2' ' A' ' 92' ' ' ASP . . . -88.62 122.23 6.29 Favored Glycine 0 C--O 1.218 -0.891 0 O-C-N 121.142 -0.974 . . . . 0.0 113.004 175.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.8 t -76.98 49.61 0.67 Allowed 'General case' 0 C--N 1.318 -0.782 0 O-C-N 120.13 -1.806 . . . . 0.0 112.378 171.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -62.75 153.45 32.75 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.92 0.888 . . . . 0.0 111.652 173.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.8 p -118.4 159.57 23.22 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.917 0.865 . . . . 0.0 112.272 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.7 t -118.31 124.8 73.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 C-N-CA 126.446 1.898 . . . . 0.0 107.43 -172.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -79.08 -177.22 5.5 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.116 1.366 . . . . 0.0 110.605 176.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.29 -21.26 5.26 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -174.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.33 52.86 1.27 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.242 1.017 . . . . 0.0 112.333 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.75 -120.24 5.18 Favored Glycine 0 CA--C 1.536 1.355 0 O-C-N 120.674 -1.266 . . . . 0.0 111.722 -170.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 60.18 171.57 0.09 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.505 1.122 . . . . 0.0 113.42 -173.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.35 111.88 23.25 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.379 -0.826 . . . . 0.0 109.949 172.366 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.5 mt -79.48 153.46 29.59 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 122.964 1.364 . . . . 0.0 112.769 176.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 18.2 mt -57.62 118.69 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 124.592 1.157 . . . . 0.0 110.338 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.9 p -146.93 130.39 16.75 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.983 0.913 . . . . 0.0 112.068 177.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -69.65 -14.21 62.7 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 120.868 -1.145 . . . . 0.0 113.223 -176.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.722 ' OD2' ' HA2' ' A' ' 77' ' ' GLY . 55.6 t0 -76.33 -15.75 59.9 Favored 'General case' 0 N--CA 1.455 -0.197 0 O-C-N 121.14 -0.975 . . . . 0.0 111.985 -177.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.3 -39.51 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 123.513 0.725 . . . . 0.0 112.4 174.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -64.14 -40.53 96.37 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 120.752 -1.217 . . . . 0.0 112.444 178.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -67.33 -30.4 70.21 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.372 1.069 . . . . 0.0 111.516 178.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -51.93 67.92 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.247 1.019 . . . . 0.0 111.605 172.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -67.34 -39.92 85.82 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.743 -0.646 . . . . 0.0 111.241 179.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.58 -45.46 93.88 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.13 0.972 . . . . 0.0 112.795 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.34 69.29 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -99.62 -14.84 18.8 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.966 0.906 . . . . 0.0 112.702 174.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.4 mt -70.98 -43.86 67.18 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.454 1.102 . . . . 0.0 112.442 171.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.1 t -68.72 -12.61 61.64 Favored 'General case' 0 N--CA 1.485 1.297 0 CA-C-N 120.553 1.524 . . . . 0.0 112.081 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -87.28 25.55 1.37 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.789 1.636 . . . . 0.0 113.871 171.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.8 p -104.84 -17.7 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 115.466 1.654 . . . . 0.0 115.466 -178.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -81.2 -51.83 4.53 Favored Glycine 0 N--CA 1.475 1.284 0 O-C-N 121.391 -0.818 . . . . 0.0 113.368 -169.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -82.31 161.08 22.73 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.744 1.218 . . . . 0.0 111.019 168.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 1.285 ' OE1' ' N ' ' A' ' 107' ' ' GLU . 0.0 OUTLIER 61.46 161.16 0.11 Allowed Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 126.672 1.989 . . . . 0.0 113.94 -178.098 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 107' ' ' GLU . 51.3 Cg_endo -63.76 127.44 19.65 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 121.618 1.546 . . . . 0.0 110.483 174.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 8.7 tt -52.52 -34.92 51.96 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.313 1.045 . . . . 0.0 112.371 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -37.97 25.55 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.518 1.127 . . . . 0.0 113.029 173.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -74.99 -29.54 60.92 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 44.8 t -62.98 -52.38 63.2 Favored 'General case' 0 N--CA 1.484 1.233 0 O-C-N 121.091 -1.006 . . . . 0.0 109.653 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.41 -32.37 73.71 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-O 117.545 -1.217 . . . . 0.0 113.401 177.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.46 -56.83 14.79 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.247 1.419 . . . . 0.0 109.596 178.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -67.82 -30.48 69.89 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 173.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.55 -63.92 1.04 Allowed 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.572 1.149 . . . . 0.0 111.751 -174.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -23.79 62.02 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 117.819 -1.086 . . . . 0.0 113.605 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.98 -50.33 66.78 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.519 0.728 . . . . 0.0 111.742 170.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.93 -47.7 84.1 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 118.895 0.771 . . . . 0.0 111.459 172.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 60.9 mt -56.32 -44.85 80.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.987 0.812 . . . . 0.0 110.836 179.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -76.19 -18.35 59.11 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -86.46 -6.26 58.95 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 173.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.485 ' OE2' ' HA ' ' A' ' 123' ' ' GLU . 27.9 mm-40 -128.49 -37.33 1.81 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -174.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.5 mp -80.69 162.14 24.29 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.137 0.494 . . . . 0.0 110.378 166.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.29 -82.9 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.188 0 CA-C-O 121.921 0.867 . . . . 0.0 113.195 -174.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -164.98 -61.41 0.01 OUTLIER Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.443 1.497 . . . . 0.0 109.528 -178.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -62.1 -42.95 26.58 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.286 1.324 . . . . 0.0 110.906 173.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -56.5 -40.74 75.48 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.273 1.029 . . . . 0.0 112.724 177.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -60.76 -41.7 96.0 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.235 1.014 . . . . 0.0 110.568 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -56.58 -39.9 86.31 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 124.421 1.01 . . . . 0.0 113.909 174.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -72.03 -38.44 69.56 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.08 0.94 . . . . 0.0 112.972 171.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.62 -50.17 73.66 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 121.352 1.887 . . . . 0.0 112.578 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.1 pp -66.58 -33.57 75.96 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 176.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.39 -50.81 70.04 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.341 -0.849 . . . . 0.0 112.02 171.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 83.2 mt -58.45 -30.78 67.21 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.441 1.019 . . . . 0.0 111.726 176.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 7.6 ttp -63.62 -64.34 0.92 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.225 1.41 . . . . 0.0 111.963 172.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -64.14 -29.32 70.45 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.872 -1.142 . . . . 0.0 112.44 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.84 -46.62 87.07 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.457 1.903 . . . . 0.0 113.269 171.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . 0.541 ' C ' ' CD1' ' A' ' 139' ' ' TYR . 0.5 OUTLIER -75.88 -22.28 56.32 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 118.145 -1.422 . . . . 0.0 109.873 -177.367 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 69.1 mt -71.58 -45.13 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.023 171.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -58.55 -45.23 89.37 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.482 1.513 . . . . 0.0 110.395 175.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -93.67 15.65 15.78 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.291 1.037 . . . . 0.0 113.588 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -64.34 -39.67 94.35 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 120.271 -1.518 . . . . 0.0 111.476 -178.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 10.3 mmpt? -74.43 118.77 17.77 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -69.37 70.28 0.26 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.418 1.087 . . . . 0.0 112.392 172.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 31.6 mt . . . . . 0 CA--C 1.55 0.951 0 C-N-CA 124.846 1.258 . . . . 0.0 112.358 171.813 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 65.9 m170 . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 93.0 mt -129.77 48.91 4.08 Favored Pre-proline 0 CA--C 1.552 1.029 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 -173.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -63.96 -24.39 67.34 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 123.456 2.771 . . . . 0.0 114.099 -175.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.1 t -93.61 6.42 48.33 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.797 1.639 . . . . 0.0 113.615 -178.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 75.0 p -66.0 154.5 39.26 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.716 -1.24 . . . . 0.0 114.151 -178.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -70.58 45.41 0.08 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.572 1.949 . . . . 0.0 115.029 -177.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.429 ' H ' ' HG2' ' A' ' 71' ' ' ARG . 10.6 ptt180 -57.21 -28.92 63.29 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 -173.045 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 64.1 -100.27 0.39 Allowed Glycine 0 CA--C 1.532 1.149 0 C-N-CA 123.637 0.637 . . . . 0.0 113.805 171.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 64.6 p -83.17 -161.57 0.52 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.09 2.156 . . . . 0.0 111.514 -178.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.8 p -86.86 94.46 9.57 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 120.228 -1.545 . . . . 0.0 111.404 165.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.9 m -64.3 144.91 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 125.05 1.34 . . . . 0.0 110.449 164.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -93.52 -51.09 5.11 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -163.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 55.98 22.17 33.9 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.951 1.263 . . . . 0.0 116.235 170.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.71 32.35 3.42 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.076 1.438 . . . . 0.0 111.59 -174.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -56.27 148.74 17.79 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.299 1.04 . . . . 0.0 112.524 -176.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.6 p -125.32 161.2 27.52 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.716 1.246 . . . . 0.0 113.476 -170.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.5 m -138.46 149.11 24.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 126.103 1.761 . . . . 0.0 109.838 -175.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -79.5 177.98 8.46 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 124.354 1.061 . . . . 0.0 111.843 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.19 13.1 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 128.32 2.648 . . . . 0.0 116.767 -177.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.8 m -156.92 30.43 0.31 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.661 1.984 . . . . 0.0 111.355 169.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.1 -127.48 8.69 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 120.557 -1.339 . . . . 0.0 112.219 -173.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.8 m-20 57.09 -170.34 0.1 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.426 1.09 . . . . 0.0 112.282 -167.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.35 116.53 26.39 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.438 -0.789 . . . . 0.0 109.823 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mt -88.64 158.02 18.37 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 123.032 1.396 . . . . 0.0 112.884 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 14.2 mt -80.2 95.11 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 124.462 1.105 . . . . 0.0 110.065 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . 0.256 8.1 t -119.45 3.92 11.22 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.006 1.323 . . . . 0.0 113.731 174.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 15.2 ttm105 65.94 -17.75 0.11 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 126.19 1.796 . . . . 0.0 115.42 -177.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -43.01 -47.02 5.71 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.862 1.665 . . . . 0.0 114.814 176.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 48.9 pt -57.18 -27.72 28.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -176.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -70.2 -48.78 55.64 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.158 0.89 . . . . 0.0 110.977 175.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -60.66 -34.4 74.26 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.38 0.672 . . . . 0.0 111.382 173.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 tt -64.09 -49.21 73.16 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.256 1.022 . . . . 0.0 111.864 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -62.8 -44.28 96.58 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.231 0.923 . . . . 0.0 112.711 171.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -56.11 -42.03 76.18 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.685 1.13 . . . . 0.0 112.308 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.28 -46.25 91.1 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.455 -0.778 . . . . 0.0 112.367 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -78.63 -21.38 48.51 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 58.7 mt -73.02 -48.33 37.19 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 118.731 0.696 . . . . 0.0 112.145 170.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 13.5 t -83.99 -8.16 59.22 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -174.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -127.34 30.99 5.29 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.315 1.446 . . . . 0.0 113.12 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 9.0 p -66.83 -38.21 81.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -171.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 72.14 -2.68 25.96 Favored Glycine 0 CA--C 1.544 1.876 0 N-CA-C 116.632 1.413 . . . . 0.0 116.632 -177.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -146.51 141.02 26.62 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.825 1.65 . . . . 0.0 110.954 -177.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -66.39 -53.39 31.02 Favored Pre-proline 0 N--CA 1.476 0.835 0 C-N-CA 123.643 0.777 . . . . 0.0 112.808 172.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.402 ' C ' ' H ' ' A' ' 110' ' ' GLN . 91.7 Cg_endo -72.77 95.17 0.8 Allowed 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 121.878 1.719 . . . . 0.0 108.435 168.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.28 9.98 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 128.748 2.819 . . . . 0.0 115.892 -177.391 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.402 ' H ' ' C ' ' A' ' 108' ' ' PRO . 0.3 OUTLIER -62.1 -47.01 86.55 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 129.087 2.955 . . . . 0.0 113.937 -169.954 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -83.27 -27.3 29.95 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.568 1.077 . . . . 0.0 112.381 -176.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 33.9 t -61.97 -48.83 78.6 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 124.716 1.207 . . . . 0.0 110.154 168.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.49 -38.84 88.13 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 118.149 -0.929 . . . . 0.0 112.15 178.251 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -54.54 -47.12 73.56 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.243 1.417 . . . . 0.0 111.544 179.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.84 -43.01 63.16 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.887 1.275 . . . . 0.0 111.907 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 52.4 tp -57.11 -53.36 58.96 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.459 1.104 . . . . 0.0 111.94 178.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -62.88 -30.13 71.29 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.504 -0.748 . . . . 0.0 112.567 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -73.94 -40.46 63.06 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.211 1.004 . . . . 0.0 111.617 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.0 -39.39 79.36 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.387 0.675 . . . . 0.0 111.066 175.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 17.0 mt -61.62 -43.32 96.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 O-C-N 121.302 -0.874 . . . . 0.0 111.175 172.284 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -69.65 -25.17 63.79 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -80.91 -36.87 30.57 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 174.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -93.98 -34.35 13.09 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -175.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 27.5 mt -81.28 170.95 15.43 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.448 1.022 . . . . 0.0 112.41 173.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.96 -78.18 0.2 Allowed 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.693 -0.63 . . . . 0.0 112.101 -167.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -162.05 -63.37 0.02 OUTLIER Pre-proline 0 CA--C 1.543 0.683 0 C-N-CA 125.581 1.553 . . . . 0.0 109.291 174.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -64.52 -37.19 39.39 Favored 'Trans proline' 0 C--N 1.356 0.922 0 CA-C-N 121.156 1.449 . . . . 0.0 111.126 174.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.27 -41.18 62.64 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.403 1.081 . . . . 0.0 112.889 172.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 8.6 ttt180 -63.39 -49.18 74.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.372 1.069 . . . . 0.0 110.587 175.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.71 -31.77 72.3 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.564 1.078 . . . . 0.0 113.894 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -77.22 -32.97 56.25 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.511 1.155 . . . . 0.0 110.95 173.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.22 -46.59 60.85 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.483 -0.761 . . . . 0.0 110.958 -175.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.1 pp -66.31 -37.96 86.61 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.133 0.573 . . . . 0.0 112.45 174.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.24 -53.58 55.02 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.85 0.75 . . . . 0.0 111.711 176.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 93.0 mt -59.66 -32.51 70.54 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 118.364 -0.827 . . . . 0.0 111.405 177.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 45.9 ttp -66.66 -51.63 53.95 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.558 0.743 . . . . 0.0 112.652 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -65.68 -40.16 92.06 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.302 -0.874 . . . . 0.0 111.763 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -44.4 97.06 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.605 1.162 . . . . 0.0 111.475 174.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -60.18 -47.08 87.46 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.646 -0.659 . . . . 0.0 111.317 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 65.1 mt -59.98 -39.68 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.623 0.769 . . . . 0.0 111.198 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -61.66 -43.23 99.26 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -92.09 6.57 46.0 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -79.11 -20.23 49.18 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.262 1.425 . . . . 0.0 112.743 174.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.2 ptpp? -82.39 138.84 34.35 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.438 0.695 . . . . 0.0 111.211 169.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -80.32 49.41 1.13 Allowed 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 176.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 39.8 mt . . . . . 0 N--CA 1.478 0.937 0 C-N-CA 126.41 1.884 . . . . 0.0 115.148 179.868 . . . . . . . . 0 0 . 1 stop_ save_