data_2mu9_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2mu9 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt . . . . . 0 CA--C 1.583 2.223 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.315 2.9 pp -81.31 -61.2 2.01 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 126.011 1.724 . . . . 0.0 107.917 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -85.28 -40.75 16.23 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 125.684 1.593 . . . . 0.0 108.865 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -59.99 -38.57 82.99 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 116.643 -1.646 . . . . 0.0 112.277 177.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -65.18 -47.34 77.31 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 121.375 1.898 . . . . 0.0 110.19 176.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.315 0.5 OUTLIER -63.18 -17.34 19.42 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.463 0 C-N-CA 125.304 1.442 . . . . 0.0 113.967 177.355 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -92.16 -37.27 12.82 Favored 'General case' 0 CA--C 1.571 1.775 0 C-N-CA 127.365 2.266 . . . . 0.0 107.364 176.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -64.1 -43.49 95.22 Favored 'General case' 0 CA--C 1.562 1.424 0 C-N-CA 126.462 1.905 . . . . 0.0 114.616 177.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -64.65 -51.1 71.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -62.1 -33.11 73.84 Favored 'General case' 0 CA--C 1.571 1.759 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.928 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt . . . . . 0 CA--C 1.569 1.711 0 CA-C-N 119.755 1.161 . . . . 0.0 113.568 177.281 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.7 mtt . . . . . 0 CA--C 1.575 1.916 0 N-CA-C 115.767 1.765 . . . . 0.0 115.767 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 76.8 mt -83.01 -77.25 0.25 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.494 1.918 . . . . 0.0 105.972 177.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -72.64 -34.07 67.03 Favored 'General case' 0 CA--C 1.565 1.523 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.836 176.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -65.66 -39.71 91.65 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-O 116.315 -1.802 . . . . 0.0 111.46 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.0 t30 -63.88 -45.26 90.21 Favored 'General case' 0 N--CA 1.501 2.123 0 CA-C-N 121.873 2.124 . . . . 0.0 110.6 176.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.321 0.5 OUTLIER -65.47 -10.43 10.05 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.501 0 C-N-CA 125.354 1.462 . . . . 0.0 114.587 177.306 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -99.3 -39.05 8.61 Favored 'General case' 0 CA--C 1.573 1.861 0 C-N-CA 128.108 2.563 . . . . 0.0 107.193 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -64.78 -44.84 88.71 Favored 'General case' 0 CA--C 1.561 1.371 0 C-N-CA 126.54 1.936 . . . . 0.0 115.123 177.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -65.5 -51.29 65.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 177.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.4 mm-40 -61.29 -31.16 70.99 Favored 'General case' 0 CA--C 1.57 1.742 0 CA-C-O 118.339 -0.838 . . . . 0.0 111.289 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 CA--C 1.565 1.555 0 CA-C-N 119.454 1.025 . . . . 0.0 111.337 177.174 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 18.8 ptt? . . . . . 0 CA--C 1.583 2.23 0 CA-C-O 120.871 0.367 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.31 2.9 pp -82.41 -60.95 2.03 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 125.811 1.644 . . . . 0.0 107.795 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -84.64 -38.79 19.41 Favored 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 125.712 1.605 . . . . 0.0 109.665 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.11 -38.43 91.16 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 116.469 -1.729 . . . . 0.0 111.658 177.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -64.53 -45.93 85.06 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-N 121.608 2.004 . . . . 0.0 109.945 176.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -65.92 -7.74 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.545 0 C-N-CA 125.329 1.451 . . . . 0.0 114.799 177.319 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -102.85 -36.9 8.07 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 128.397 2.679 . . . . 0.0 107.193 176.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -65.5 -41.17 93.51 Favored 'General case' 0 CA--C 1.56 1.356 0 C-N-CA 126.546 1.938 . . . . 0.0 115.545 177.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.28 1.8 mp -64.79 -53.55 40.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -62.24 -30.88 71.41 Favored 'General case' 0 CA--C 1.572 1.794 0 CA-C-O 117.99 -1.005 . . . . 0.0 111.129 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt . . . . . 0 CA--C 1.569 1.685 0 CA-C-N 119.905 1.229 . . . . 0.0 112.258 177.138 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.6 mtt . . . . . 0 CA--C 1.575 1.921 0 N-CA-C 115.839 1.792 . . . . 0.0 115.839 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 81.7 mt -84.13 -75.37 0.34 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.779 2.032 . . . . 0.0 105.961 177.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -71.73 -34.67 69.74 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 118.082 -0.961 . . . . 0.0 111.01 176.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.18 -39.52 89.77 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 116.341 -1.79 . . . . 0.0 111.13 177.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -63.63 -45.88 88.24 Favored 'General case' 0 N--CA 1.501 2.105 0 CA-C-N 121.842 2.11 . . . . 0.0 110.642 176.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -64.6 -12.92 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 C-N-CA 125.251 1.42 . . . . 0.0 114.469 177.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -96.3 -39.49 9.61 Favored 'General case' 0 CA--C 1.573 1.828 0 C-N-CA 127.71 2.404 . . . . 0.0 107.028 176.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -64.23 -44.21 92.58 Favored 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 126.598 1.959 . . . . 0.0 115.072 177.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.8 mp -64.37 -51.42 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 177.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.2 mm-40 -62.32 -32.97 73.8 Favored 'General case' 0 CA--C 1.57 1.733 0 CA-C-O 118.289 -0.862 . . . . 0.0 110.911 176.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt . . . . . 0 CA--C 1.571 1.752 0 CA-C-N 119.818 1.19 . . . . 0.0 113.182 177.155 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.1 mtt . . . . . 0 CA--C 1.58 2.131 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.321 3.0 pp -81.03 -60.61 2.23 Favored 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 125.531 1.532 . . . . 0.0 107.684 177.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -87.27 -37.77 16.9 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 125.591 1.556 . . . . 0.0 109.435 176.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -62.64 -38.52 90.58 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 116.508 -1.711 . . . . 0.0 111.729 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -64.61 -46.52 82.3 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 121.552 1.978 . . . . 0.0 109.977 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.319 0.5 OUTLIER -65.13 -9.99 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 C-N-CA 125.311 1.444 . . . . 0.0 114.707 177.269 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -100.24 -37.05 9.07 Favored 'General case' 0 CA--C 1.575 1.94 0 C-N-CA 128.223 2.609 . . . . 0.0 107.195 176.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -65.01 -40.97 95.69 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 126.544 1.938 . . . . 0.0 115.558 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.276 1.9 mp -65.35 -53.86 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 177.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -62.23 -29.0 70.08 Favored 'General case' 0 CA--C 1.572 1.81 0 CA-C-O 117.69 -1.148 . . . . 0.0 111.344 176.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.7 ttpt . . . . . 0 CA--C 1.57 1.73 0 CA-C-N 120.097 1.317 . . . . 0.0 112.101 177.102 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.7 mtt . . . . . 0 CA--C 1.574 1.894 0 N-CA-C 115.956 1.835 . . . . 0.0 115.956 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 73.1 mt -81.78 -77.02 0.23 Allowed 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 177.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -74.42 -33.78 63.07 Favored 'General case' 0 CA--C 1.565 1.537 0 CA-C-O 118.077 -0.963 . . . . 0.0 110.84 176.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.68 -39.7 91.58 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 116.287 -1.816 . . . . 0.0 111.399 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -63.31 -46.61 85.9 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-N 121.891 2.132 . . . . 0.0 110.43 176.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.62 -14.2 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.383 0 C-N-CA 125.301 1.44 . . . . 0.0 114.52 177.433 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -96.56 -36.56 10.71 Favored 'General case' 0 CA--C 1.573 1.853 0 C-N-CA 127.525 2.33 . . . . 0.0 107.269 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -63.09 -39.72 95.55 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 126.465 1.906 . . . . 0.0 115.55 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.9 mp -64.59 -53.98 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 177.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -63.55 -31.65 72.87 Favored 'General case' 0 CA--C 1.571 1.78 0 CA-C-O 117.902 -1.046 . . . . 0.0 110.881 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt . . . . . 0 CA--C 1.57 1.738 0 CA-C-N 120.363 1.438 . . . . 0.0 113.315 177.14 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt . . . . . 0 CA--C 1.582 2.185 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.317 3.0 pp -81.73 -60.12 2.36 Favored 'General case' 0 CA--C 1.559 1.323 0 C-N-CA 125.675 1.59 . . . . 0.0 108.187 177.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.05 -42.29 14.98 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 125.599 1.56 . . . . 0.0 108.656 176.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -59.15 -38.34 79.46 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 116.591 -1.671 . . . . 0.0 112.537 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -65.37 -47.17 77.32 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 121.404 1.911 . . . . 0.0 110.207 176.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.317 0.5 OUTLIER -63.16 -17.24 19.21 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.45 0 C-N-CA 125.337 1.455 . . . . 0.0 113.983 177.301 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -92.47 -36.43 13.09 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 127.445 2.298 . . . . 0.0 107.614 176.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -65.09 -43.84 90.81 Favored 'General case' 0 CA--C 1.563 1.459 0 C-N-CA 126.433 1.893 . . . . 0.0 114.395 177.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -64.63 -50.84 73.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -62.2 -33.46 74.59 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.779 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt . . . . . 0 CA--C 1.571 1.762 0 CA-C-N 119.921 1.237 . . . . 0.0 113.475 177.245 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.5 mtt . . . . . 0 CA--C 1.575 1.924 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 76.3 mt -82.75 -77.42 0.24 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.543 1.937 . . . . 0.0 105.935 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 tttp -72.6 -33.63 66.82 Favored 'General case' 0 CA--C 1.565 1.541 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.862 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.66 -40.4 92.39 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 116.517 -1.706 . . . . 0.0 111.279 177.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -63.87 -45.68 88.32 Favored 'General case' 0 N--CA 1.501 2.102 0 CA-C-N 121.623 2.01 . . . . 0.0 110.855 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -63.3 -18.94 22.78 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.433 0 C-N-CA 125.157 1.383 . . . . 0.0 113.741 177.306 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -88.89 -39.69 13.62 Favored 'General case' 0 CA--C 1.572 1.821 0 C-N-CA 126.983 2.113 . . . . 0.0 107.211 176.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -65.55 -44.27 87.32 Favored 'General case' 0 CA--C 1.563 1.465 0 C-N-CA 126.355 1.862 . . . . 0.0 114.828 177.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.7 mp -65.88 -52.15 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -60.79 -31.69 71.06 Favored 'General case' 0 CA--C 1.571 1.783 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.248 176.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 CA--C 1.567 1.6 0 CA-C-N 119.638 1.108 . . . . 0.0 111.995 177.168 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 32.9 mtm . . . . . 0 CA--C 1.583 2.236 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.311 2.9 pp -81.89 -61.17 1.99 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 125.847 1.659 . . . . 0.0 108.109 177.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -84.5 -38.6 19.89 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 125.609 1.564 . . . . 0.0 109.822 176.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.09 -38.58 91.74 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 116.726 -1.606 . . . . 0.0 111.763 177.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -65.28 -46.29 81.06 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 121.36 1.891 . . . . 0.0 110.341 176.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.32 0.5 OUTLIER -63.27 -18.72 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.403 0 C-N-CA 125.161 1.384 . . . . 0.0 113.804 177.278 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -89.48 -37.91 14.42 Favored 'General case' 0 CA--C 1.572 1.818 0 C-N-CA 127.116 2.166 . . . . 0.0 107.426 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -66.06 -44.67 83.88 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 126.457 1.903 . . . . 0.0 114.546 177.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -66.07 -52.0 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 107.07 -1.455 . . . . 0.0 107.07 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -60.58 -30.57 69.89 Favored 'General case' 0 CA--C 1.572 1.805 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.329 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt . . . . . 0 CA--C 1.567 1.618 0 CA-C-N 119.768 1.167 . . . . 0.0 111.609 177.136 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.9 mtt . . . . . 0 CA--C 1.575 1.927 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.8 mt -83.82 -75.52 0.33 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.938 2.095 . . . . 0.0 105.671 177.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -72.55 -33.76 67.05 Favored 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.121 176.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -66.87 -39.01 87.39 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-O 116.34 -1.79 . . . . 0.0 111.16 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -63.69 -46.35 85.93 Favored 'General case' 0 N--CA 1.501 2.107 0 CA-C-N 121.857 2.117 . . . . 0.0 110.561 176.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.321 0.5 OUTLIER -63.45 -15.91 17.13 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.438 0 C-N-CA 125.286 1.434 . . . . 0.0 114.349 177.376 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -92.98 -40.95 10.27 Favored 'General case' 0 CA--C 1.571 1.783 0 C-N-CA 127.452 2.301 . . . . 0.0 106.717 176.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -62.28 -41.83 98.82 Favored 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 126.453 1.901 . . . . 0.0 115.004 177.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.277 1.8 mp -65.78 -51.89 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -60.56 -31.72 70.82 Favored 'General case' 0 CA--C 1.572 1.804 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.414 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.9 tmmm? . . . . . 0 CA--C 1.568 1.635 0 CA-C-N 119.305 0.957 . . . . 0.0 111.524 177.307 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.7 mtt . . . . . 0 CA--C 1.577 1.984 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.6 mt -86.24 -74.71 0.41 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.13 2.172 . . . . 0.0 106.103 177.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -69.6 -34.77 74.57 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.846 176.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.26 -39.56 89.54 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-O 116.309 -1.805 . . . . 0.0 110.654 177.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -62.78 -46.98 85.47 Favored 'General case' 0 N--CA 1.501 2.079 0 CA-C-N 121.764 2.075 . . . . 0.0 110.525 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.61 -14.23 14.36 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.405 0 C-N-CA 125.304 1.442 . . . . 0.0 114.659 177.427 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -95.21 -38.36 10.61 Favored 'General case' 0 CA--C 1.575 1.927 0 C-N-CA 127.609 2.364 . . . . 0.0 107.029 176.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -63.19 -40.74 98.36 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 126.629 1.972 . . . . 0.0 115.422 177.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.8 mp -65.32 -54.32 30.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 177.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -62.54 -28.38 69.82 Favored 'General case' 0 CA--C 1.574 1.886 0 CA-C-O 117.813 -1.089 . . . . 0.0 111.459 176.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt . . . . . 0 CA--C 1.568 1.64 0 CA-C-N 119.922 1.237 . . . . 0.0 112.023 177.175 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt . . . . . 0 CA--C 1.583 2.218 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.321 3.2 pp -82.48 -60.16 2.29 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 125.536 1.534 . . . . 0.0 107.9 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.65 -37.75 20.65 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 125.552 1.541 . . . . 0.0 109.853 176.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.63 -39.15 93.64 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 116.925 -1.512 . . . . 0.0 111.62 177.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -64.59 -46.37 82.99 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 121.164 1.802 . . . . 0.0 110.644 176.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -63.35 -19.37 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.457 0 C-N-CA 125.149 1.38 . . . . 0.0 113.569 177.261 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -88.96 -36.59 15.79 Favored 'General case' 0 CA--C 1.573 1.858 0 C-N-CA 127.094 2.158 . . . . 0.0 107.678 176.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -66.11 -45.21 81.94 Favored 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 126.488 1.915 . . . . 0.0 114.338 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.281 1.9 mp -66.96 -51.49 54.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 177.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -60.26 -29.88 69.07 Favored 'General case' 0 CA--C 1.572 1.824 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.117 176.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 CA--C 1.567 1.622 0 CA-C-N 119.515 1.052 . . . . 0.0 110.526 177.049 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.9 mtt . . . . . 0 CA--C 1.573 1.865 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.6 mt -86.31 -74.6 0.41 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.464 1.906 . . . . 0.0 106.147 177.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -70.6 -34.05 71.73 Favored 'General case' 0 CA--C 1.563 1.451 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.959 176.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.92 -39.45 87.38 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 116.449 -1.739 . . . . 0.0 110.792 177.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -63.17 -46.75 85.7 Favored 'General case' 0 N--CA 1.501 2.1 0 CA-C-N 121.753 2.07 . . . . 0.0 110.698 176.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.02 -17.57 19.69 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.374 0 C-N-CA 125.26 1.424 . . . . 0.0 114.084 177.35 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -91.36 -39.12 12.2 Favored 'General case' 0 CA--C 1.57 1.738 0 C-N-CA 127.16 2.184 . . . . 0.0 107.182 176.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -62.02 -44.46 96.68 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 126.597 1.959 . . . . 0.0 115.311 177.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -64.32 -51.33 69.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 177.305 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -61.95 -33.4 74.22 Favored 'General case' 0 CA--C 1.57 1.733 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.973 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt . . . . . 0 CA--C 1.568 1.656 0 CA-C-N 119.946 1.248 . . . . 0.0 113.646 177.372 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.2 ptp . . . . . 0 CA--C 1.581 2.158 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.319 3.0 pp -82.45 -61.39 1.9 Allowed 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 125.811 1.644 . . . . 0.0 107.471 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.4 tttp -84.79 -37.62 20.57 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 125.49 1.516 . . . . 0.0 109.537 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.96 -38.84 92.72 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 116.583 -1.675 . . . . 0.0 111.519 177.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -64.12 -46.81 82.52 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 121.423 1.919 . . . . 0.0 110.093 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.318 0.5 OUTLIER -64.36 -11.89 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.481 0 C-N-CA 125.319 1.448 . . . . 0.0 114.6 177.285 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -98.34 -37.32 9.68 Favored 'General case' 0 CA--C 1.575 1.906 0 C-N-CA 127.913 2.485 . . . . 0.0 107.26 176.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -64.57 -41.25 96.41 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 126.577 1.951 . . . . 0.0 115.645 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.277 1.8 mp -64.68 -52.16 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 124.383 1.073 . . . . 0.0 108.105 177.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -64.05 -32.81 74.49 Favored 'General case' 0 CA--C 1.571 1.774 0 CA-C-O 117.792 -1.099 . . . . 0.0 110.67 176.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt . . . . . 0 CA--C 1.567 1.61 0 CA-C-N 120.057 1.299 . . . . 0.0 114.179 177.356 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.3 mtp . . . . . 0 CA--C 1.571 1.775 0 N-CA-C 116.875 2.176 . . . . 0.0 116.875 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.1 mt -79.55 -78.26 0.16 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.844 2.057 . . . . 0.0 108.629 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -72.37 -33.24 67.1 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-O 117.707 -1.139 . . . . 0.0 112.588 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . 0.262 0.2 OUTLIER -67.42 -41.22 85.2 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 116.93 -1.51 . . . . 0.0 111.306 177.386 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -62.23 -46.31 89.42 Favored 'General case' 0 N--CA 1.501 2.117 0 CA-C-N 120.639 1.563 . . . . 0.0 111.267 176.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.325 0.5 OUTLIER -62.7 -21.44 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.323 0 C-N-CA 125.149 1.38 . . . . 0.0 113.665 177.325 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -87.14 -37.5 17.29 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 126.618 1.967 . . . . 0.0 107.54 176.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -64.07 -44.86 91.12 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 126.467 1.907 . . . . 0.0 114.638 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.272 1.8 mp -65.71 -52.47 49.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -61.15 -28.28 69.0 Favored 'General case' 0 CA--C 1.572 1.815 0 CA-C-O 118.006 -0.997 . . . . 0.0 111.789 176.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt . . . . . 0 CA--C 1.567 1.62 0 CA-C-N 119.929 1.241 . . . . 0.0 111.762 177.193 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 18.8 ptt? . . . . . 0 CA--C 1.583 2.24 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.32 3.1 pp -83.16 -61.45 1.85 Allowed 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 125.827 1.651 . . . . 0.0 107.468 177.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -82.98 -37.25 24.29 Favored 'General case' 0 CA--C 1.561 1.402 0 C-N-CA 125.225 1.41 . . . . 0.0 109.641 176.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -63.01 -39.24 94.17 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 116.743 -1.598 . . . . 0.0 111.262 177.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -63.93 -46.76 83.3 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 121.23 1.832 . . . . 0.0 109.981 176.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.317 0.5 OUTLIER -65.26 -9.66 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.482 0 C-N-CA 125.323 1.449 . . . . 0.0 114.748 177.285 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -99.73 -37.37 9.13 Favored 'General case' 0 CA--C 1.577 1.99 0 C-N-CA 128.272 2.629 . . . . 0.0 107.066 176.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -65.5 -41.29 93.4 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 126.632 1.973 . . . . 0.0 115.278 177.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.276 1.8 mp -64.95 -53.52 40.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -61.98 -31.27 71.62 Favored 'General case' 0 CA--C 1.572 1.8 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.897 176.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt . . . . . 0 CA--C 1.567 1.628 0 CA-C-N 119.875 1.216 . . . . 0.0 111.664 177.135 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.8 mtt . . . . . 0 CA--C 1.576 1.955 0 N-CA-C 115.894 1.813 . . . . 0.0 115.894 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 74.4 mt -80.59 -76.96 0.21 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.758 2.023 . . . . 0.0 105.666 177.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -75.58 -33.59 60.6 Favored 'General case' 0 CA--C 1.564 1.512 0 CA-C-O 117.806 -1.092 . . . . 0.0 110.789 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.29 -39.7 92.89 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 116.455 -1.736 . . . . 0.0 111.701 177.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -64.22 -45.96 85.94 Favored 'General case' 0 N--CA 1.501 2.101 0 CA-C-N 121.679 2.036 . . . . 0.0 110.669 176.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.48 -17.39 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.443 0 C-N-CA 125.279 1.432 . . . . 0.0 114.01 177.361 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -90.91 -40.09 11.91 Favored 'General case' 0 CA--C 1.57 1.722 0 C-N-CA 127.283 2.233 . . . . 0.0 107.069 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -63.2 -43.94 96.74 Favored 'General case' 0 CA--C 1.561 1.403 0 C-N-CA 126.414 1.886 . . . . 0.0 115.086 177.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.281 1.8 mp -65.93 -52.57 47.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 177.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.6 -30.19 69.67 Favored 'General case' 0 CA--C 1.572 1.806 0 CA-C-O 118.44 -0.79 . . . . 0.0 111.693 176.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt . . . . . 0 CA--C 1.565 1.521 0 CA-C-N 119.37 0.987 . . . . 0.0 111.46 177.262 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 33.1 mtm . . . . . 0 CA--C 1.574 1.872 0 N-CA-C 115.864 1.802 . . . . 0.0 115.864 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 84.3 mt -89.76 -69.81 0.7 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.361 2.264 . . . . 0.0 105.353 177.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -67.68 -35.51 78.97 Favored 'General case' 0 CA--C 1.563 1.469 0 C-N-CA 124.014 0.926 . . . . 0.0 111.661 176.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.74 -39.9 80.13 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 116.501 -1.714 . . . . 0.0 109.967 176.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -62.1 -46.79 87.51 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-N 121.542 1.974 . . . . 0.0 110.962 176.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.324 0.5 OUTLIER -62.48 -21.64 27.67 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.381 0 C-N-CA 125.174 1.39 . . . . 0.0 113.687 177.35 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -86.48 -37.84 17.88 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 126.692 1.997 . . . . 0.0 107.623 176.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -64.95 -44.77 88.32 Favored 'General case' 0 CA--C 1.562 1.416 0 C-N-CA 126.418 1.887 . . . . 0.0 114.701 177.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.8 mp -66.17 -52.2 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 177.394 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -60.87 -30.06 69.92 Favored 'General case' 0 CA--C 1.572 1.821 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.391 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt . . . . . 0 CA--C 1.565 1.548 0 CA-C-N 119.725 1.148 . . . . 0.0 110.881 177.131 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.5 mtt . . . . . 0 CA--C 1.575 1.91 0 N-CA-C 116.094 1.886 . . . . 0.0 116.094 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 81.2 mt -83.9 -75.22 0.34 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.76 2.024 . . . . 0.0 105.717 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -72.53 -33.93 67.2 Favored 'General case' 0 CA--C 1.561 1.391 0 CA-C-O 117.955 -1.022 . . . . 0.0 111.07 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -66.73 -39.21 87.89 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 116.502 -1.713 . . . . 0.0 111.216 177.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -63.79 -46.3 85.81 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 121.695 2.043 . . . . 0.0 110.799 176.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -62.75 -20.22 24.82 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.369 0 C-N-CA 125.154 1.382 . . . . 0.0 113.746 177.292 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -87.82 -38.87 15.33 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 126.937 2.095 . . . . 0.0 107.347 176.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -64.54 -44.87 89.46 Favored 'General case' 0 CA--C 1.561 1.378 0 C-N-CA 126.351 1.86 . . . . 0.0 114.992 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.8 mp -65.69 -52.19 53.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.412 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -60.76 -31.72 71.05 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.367 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm . . . . . 0 CA--C 1.564 1.516 0 CA-C-N 119.737 1.153 . . . . 0.0 111.877 177.245 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.3 mtp . . . . . 0 CA--C 1.575 1.908 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 73.9 mt -81.17 -78.09 0.19 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.673 1.989 . . . . 0.0 106.306 177.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -72.93 -33.78 66.15 Favored 'General case' 0 CA--C 1.563 1.466 0 CA-C-O 117.769 -1.11 . . . . 0.0 110.894 176.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -64.69 -40.66 95.76 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 116.636 -1.65 . . . . 0.0 111.448 177.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -63.86 -46.3 85.61 Favored 'General case' 0 N--CA 1.501 2.121 0 CA-C-N 121.428 1.922 . . . . 0.0 110.785 176.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -62.83 -19.94 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.395 0 C-N-CA 125.255 1.422 . . . . 0.0 113.812 177.298 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -88.14 -37.12 16.44 Favored 'General case' 0 CA--C 1.573 1.839 0 C-N-CA 126.91 2.084 . . . . 0.0 107.508 176.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -65.6 -44.87 85.28 Favored 'General case' 0 CA--C 1.563 1.477 0 C-N-CA 126.428 1.891 . . . . 0.0 114.387 177.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -66.1 -51.71 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -60.22 -31.89 70.6 Favored 'General case' 0 CA--C 1.57 1.749 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.123 176.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 CA--C 1.567 1.62 0 CA-C-N 119.799 1.182 . . . . 0.0 111.762 177.179 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 30.4 mtp . . . . . 0 CA--C 1.583 2.22 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.312 2.8 pp -80.75 -61.51 1.95 Allowed 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 125.935 1.694 . . . . 0.0 107.906 177.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -86.67 -37.5 17.94 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.578 1.551 . . . . 0.0 109.5 176.925 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -63.0 -38.58 91.77 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-O 116.782 -1.58 . . . . 0.0 111.973 177.313 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -65.75 -46.15 79.94 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 121.339 1.881 . . . . 0.0 110.328 176.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.319 0.5 OUTLIER -64.06 -16.35 18.68 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.424 0 C-N-CA 125.201 1.4 . . . . 0.0 113.757 177.193 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -91.27 -39.11 12.26 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 127.452 2.301 . . . . 0.0 107.24 176.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -65.01 -47.91 75.8 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 126.406 1.882 . . . . 0.0 115.187 177.636 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.267 1.8 mp -65.93 -51.3 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 177.534 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -60.14 -32.64 71.21 Favored 'General case' 0 CA--C 1.567 1.634 0 CA-C-O 117.612 -1.185 . . . . 0.0 111.252 176.512 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm . . . . . 0 CA--C 1.567 1.607 0 CA-C-N 120.152 1.342 . . . . 0.0 111.679 177.214 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 103.399 -2.815 . . . . 0.0 103.399 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -146.56 65.32 1.19 Allowed 'General case' 0 CA--C 1.562 1.44 0 CA-C-O 122.934 1.35 . . . . 0.0 111.778 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -152.1 -52.44 0.12 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 125.803 1.641 . . . . 0.0 107.815 177.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt -77.86 28.21 0.17 Allowed 'General case' 0 CA--C 1.583 2.223 0 CA-C-N 119.531 1.06 . . . . 0.0 112.455 176.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.315 2.9 pp -81.31 -61.2 2.01 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 126.011 1.724 . . . . 0.0 107.917 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -85.28 -40.75 16.23 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 125.684 1.593 . . . . 0.0 108.865 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -59.99 -38.57 82.99 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 116.643 -1.646 . . . . 0.0 112.277 177.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -65.18 -47.34 77.31 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 121.375 1.898 . . . . 0.0 110.19 176.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.315 0.5 OUTLIER -63.18 -17.34 19.42 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.463 0 C-N-CA 125.304 1.442 . . . . 0.0 113.967 177.355 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -92.16 -37.27 12.82 Favored 'General case' 0 CA--C 1.571 1.775 0 C-N-CA 127.365 2.266 . . . . 0.0 107.364 176.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -64.1 -43.49 95.22 Favored 'General case' 0 CA--C 1.562 1.424 0 C-N-CA 126.462 1.905 . . . . 0.0 114.616 177.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -64.65 -51.1 71.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -62.1 -33.11 73.84 Favored 'General case' 0 CA--C 1.571 1.759 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.928 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -68.1 -34.42 76.37 Favored 'General case' 0 CA--C 1.569 1.711 0 CA-C-N 119.755 1.161 . . . . 0.0 113.568 177.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -61.62 -51.56 68.0 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 115.198 1.555 . . . . 0.0 115.198 177.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -79.67 -43.55 22.56 Favored 'General case' 0 CA--C 1.56 1.356 0 N-CA-C 116.698 2.11 . . . . 0.0 116.698 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -85.23 -35.96 21.25 Favored 'General case' 0 CA--C 1.564 1.496 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.0 mt 58.75 60.91 2.34 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 114.911 1.449 . . . . 0.0 114.911 177.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -87.24 56.15 3.85 Favored 'General case' 0 CA--C 1.57 1.741 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm . . . . . 0 N--CA 1.483 1.188 0 O-C-N 120.951 -1.093 . . . . 0.0 110.887 -179.936 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.243 0 N-CA-C 103.747 -2.686 . . . . 0.0 103.747 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -142.66 60.63 1.43 Allowed 'General case' 0 CA--C 1.557 1.229 0 CA-C-O 122.827 1.299 . . . . 0.0 111.358 -179.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -143.44 -60.84 0.41 Allowed 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 177.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.7 mtt -73.16 19.3 0.09 Allowed 'General case' 0 CA--C 1.575 1.916 0 N-CA-C 115.767 1.765 . . . . 0.0 115.767 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 76.8 mt -83.01 -77.25 0.25 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.494 1.918 . . . . 0.0 105.972 177.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -72.64 -34.07 67.03 Favored 'General case' 0 CA--C 1.565 1.523 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.836 176.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -65.66 -39.71 91.65 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-O 116.315 -1.802 . . . . 0.0 111.46 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.0 t30 -63.88 -45.26 90.21 Favored 'General case' 0 N--CA 1.501 2.123 0 CA-C-N 121.873 2.124 . . . . 0.0 110.6 176.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.321 0.5 OUTLIER -65.47 -10.43 10.05 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.501 0 C-N-CA 125.354 1.462 . . . . 0.0 114.587 177.306 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -99.3 -39.05 8.61 Favored 'General case' 0 CA--C 1.573 1.861 0 C-N-CA 128.108 2.563 . . . . 0.0 107.193 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -64.78 -44.84 88.71 Favored 'General case' 0 CA--C 1.561 1.371 0 C-N-CA 126.54 1.936 . . . . 0.0 115.123 177.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -65.5 -51.29 65.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 177.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.4 mm-40 -61.29 -31.16 70.99 Favored 'General case' 0 CA--C 1.57 1.742 0 CA-C-O 118.339 -0.838 . . . . 0.0 111.289 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -68.33 -50.74 51.29 Favored 'General case' 0 CA--C 1.565 1.555 0 CA-C-N 119.454 1.025 . . . . 0.0 111.337 177.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -53.25 -53.34 52.26 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 114.911 1.449 . . . . 0.0 114.911 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.266 39.3 tp60 -57.42 -44.93 85.03 Favored 'General case' 0 CA--C 1.562 1.42 0 C-N-CA 126.841 2.056 . . . . 0.0 115.622 177.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -62.54 -37.19 85.15 Favored 'General case' 0 CA--C 1.565 1.536 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 177.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.7 mt -64.15 -22.14 66.82 Favored 'General case' 0 CA--C 1.563 1.442 0 N-CA-C 118.095 2.628 . . . . 0.0 118.095 177.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -77.76 76.92 4.28 Favored 'General case' 0 CA--C 1.573 1.86 0 C-N-CA 124.582 1.153 . . . . 0.0 112.864 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.6 tptm . . . . . 0 N--CA 1.485 1.291 0 O-C-N 120.769 -1.207 . . . . 0.0 110.757 -179.973 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 102.386 -3.19 . . . . 0.0 102.386 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.3 ptt? -149.11 65.82 1.03 Allowed 'General case' 0 CA--C 1.563 1.447 0 CA-C-O 122.615 1.198 . . . . 0.0 111.922 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -152.47 -53.42 0.12 Allowed 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 125.4 1.48 . . . . 0.0 107.893 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 18.8 ptt? -79.94 31.43 0.26 Allowed 'General case' 0 CA--C 1.583 2.23 0 CA-C-N 119.737 1.153 . . . . 0.0 111.836 176.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.31 2.9 pp -82.41 -60.95 2.03 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 125.811 1.644 . . . . 0.0 107.795 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -84.64 -38.79 19.41 Favored 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 125.712 1.605 . . . . 0.0 109.665 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.11 -38.43 91.16 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 116.469 -1.729 . . . . 0.0 111.658 177.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -64.53 -45.93 85.06 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-N 121.608 2.004 . . . . 0.0 109.945 176.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -65.92 -7.74 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.545 0 C-N-CA 125.329 1.451 . . . . 0.0 114.799 177.319 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -102.85 -36.9 8.07 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 128.397 2.679 . . . . 0.0 107.193 176.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -65.5 -41.17 93.51 Favored 'General case' 0 CA--C 1.56 1.356 0 C-N-CA 126.546 1.938 . . . . 0.0 115.545 177.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.28 1.8 mp -64.79 -53.55 40.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -62.24 -30.88 71.41 Favored 'General case' 0 CA--C 1.572 1.794 0 CA-C-O 117.99 -1.005 . . . . 0.0 111.129 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -69.18 -46.62 67.06 Favored 'General case' 0 CA--C 1.569 1.685 0 CA-C-N 119.905 1.229 . . . . 0.0 112.258 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -50.61 -56.98 9.33 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 177.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -67.97 -31.45 71.18 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 116.27 1.952 . . . . 0.0 116.27 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.6 t30 -66.98 -37.29 83.97 Favored 'General case' 0 CA--C 1.563 1.455 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 177.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 mt -60.22 -61.49 2.57 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 124.553 1.141 . . . . 0.0 112.642 177.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 31.6 p90 -99.93 58.5 1.02 Allowed 'General case' 0 CA--C 1.57 1.727 0 C-N-CA 125.414 1.486 . . . . 0.0 110.692 177.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 44.8 tptt . . . . . 0 N--CA 1.483 1.185 0 O-C-N 120.954 -1.091 . . . . 0.0 111.947 -179.69 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 103.162 -2.903 . . . . 0.0 103.162 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -144.47 60.71 1.34 Allowed 'General case' 0 CA--C 1.557 1.236 0 CA-C-O 122.683 1.23 . . . . 0.0 111.372 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -143.76 -59.77 0.4 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 177.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.6 mtt -72.68 17.47 0.11 Allowed 'General case' 0 CA--C 1.575 1.921 0 N-CA-C 115.839 1.792 . . . . 0.0 115.839 177.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 81.7 mt -84.13 -75.37 0.34 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.779 2.032 . . . . 0.0 105.961 177.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -71.73 -34.67 69.74 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 118.082 -0.961 . . . . 0.0 111.01 176.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.18 -39.52 89.77 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 116.341 -1.79 . . . . 0.0 111.13 177.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -63.63 -45.88 88.24 Favored 'General case' 0 N--CA 1.501 2.105 0 CA-C-N 121.842 2.11 . . . . 0.0 110.642 176.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -64.6 -12.92 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 C-N-CA 125.251 1.42 . . . . 0.0 114.469 177.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -96.3 -39.49 9.61 Favored 'General case' 0 CA--C 1.573 1.828 0 C-N-CA 127.71 2.404 . . . . 0.0 107.028 176.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -64.23 -44.21 92.58 Favored 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 126.598 1.959 . . . . 0.0 115.072 177.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.8 mp -64.37 -51.42 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 177.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.2 mm-40 -62.32 -32.97 73.8 Favored 'General case' 0 CA--C 1.57 1.733 0 CA-C-O 118.289 -0.862 . . . . 0.0 110.911 176.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -67.41 -37.93 83.84 Favored 'General case' 0 CA--C 1.571 1.752 0 CA-C-N 119.818 1.19 . . . . 0.0 113.182 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -62.12 -53.18 59.08 Favored 'General case' 0 CA--C 1.559 1.316 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 177.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -77.61 -43.3 32.01 Favored 'General case' 0 CA--C 1.559 1.324 0 N-CA-C 117.268 2.321 . . . . 0.0 117.268 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -87.52 -33.75 18.85 Favored 'General case' 0 CA--C 1.559 1.307 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mt 56.42 71.06 0.59 Allowed 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 119.756 1.162 . . . . 0.0 113.626 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -76.92 79.03 3.49 Favored 'General case' 0 CA--C 1.574 1.88 0 C-N-CA 123.895 0.878 . . . . 0.0 113.062 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.4 tttp . . . . . 0 N--CA 1.487 1.395 0 O-C-N 120.836 -1.165 . . . . 0.0 112.268 -179.974 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.2 mmt -138.82 59.99 1.61 Allowed 'General case' 0 CA--C 1.563 1.45 0 C-N-CA 125.195 1.398 . . . . 0.0 111.282 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 -137.18 -53.82 0.69 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 125.74 1.616 . . . . 0.0 107.827 177.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.1 mtt -75.84 26.81 0.11 Allowed 'General case' 0 CA--C 1.58 2.131 0 CA-C-N 119.511 1.05 . . . . 0.0 113.283 177.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.321 3.0 pp -81.03 -60.61 2.23 Favored 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 125.531 1.532 . . . . 0.0 107.684 177.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -87.27 -37.77 16.9 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 125.591 1.556 . . . . 0.0 109.435 176.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -62.64 -38.52 90.58 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 116.508 -1.711 . . . . 0.0 111.729 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -64.61 -46.52 82.3 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 121.552 1.978 . . . . 0.0 109.977 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.319 0.5 OUTLIER -65.13 -9.99 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 C-N-CA 125.311 1.444 . . . . 0.0 114.707 177.269 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -100.24 -37.05 9.07 Favored 'General case' 0 CA--C 1.575 1.94 0 C-N-CA 128.223 2.609 . . . . 0.0 107.195 176.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -65.01 -40.97 95.69 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 126.544 1.938 . . . . 0.0 115.558 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.276 1.9 mp -65.35 -53.86 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 177.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -62.23 -29.0 70.08 Favored 'General case' 0 CA--C 1.572 1.81 0 CA-C-O 117.69 -1.148 . . . . 0.0 111.344 176.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.7 ttpt -71.34 -45.67 62.4 Favored 'General case' 0 CA--C 1.57 1.73 0 CA-C-N 120.097 1.317 . . . . 0.0 112.101 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.0 t30 -50.54 -54.1 25.09 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 177.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -79.78 -27.04 40.45 Favored 'General case' 0 CA--C 1.568 1.639 0 N-CA-C 116.248 1.944 . . . . 0.0 116.248 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -149.88 82.54 1.39 Allowed 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.3 mt -43.88 -40.43 4.54 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 177.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -59.73 -50.38 74.05 Favored 'General case' 0 CA--C 1.565 1.534 0 C-N-CA 125.694 1.598 . . . . 0.0 114.329 177.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.555 1.145 0 C-N-CA 124.917 1.287 . . . . 0.0 107.951 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.482 1.143 0 N-CA-C 102.733 -3.062 . . . . 0.0 102.733 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.77 55.89 1.49 Allowed 'General case' 0 CA--C 1.558 1.274 0 CA-C-O 122.488 1.137 . . . . 0.0 112.938 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -141.94 -61.19 0.46 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 177.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.7 mtt -72.12 19.0 0.08 Allowed 'General case' 0 CA--C 1.574 1.894 0 N-CA-C 115.956 1.835 . . . . 0.0 115.956 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 73.1 mt -81.78 -77.02 0.23 Allowed 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 177.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -74.42 -33.78 63.07 Favored 'General case' 0 CA--C 1.565 1.537 0 CA-C-O 118.077 -0.963 . . . . 0.0 110.84 176.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.68 -39.7 91.58 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 116.287 -1.816 . . . . 0.0 111.399 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -63.31 -46.61 85.9 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-N 121.891 2.132 . . . . 0.0 110.43 176.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.62 -14.2 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.383 0 C-N-CA 125.301 1.44 . . . . 0.0 114.52 177.433 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -96.56 -36.56 10.71 Favored 'General case' 0 CA--C 1.573 1.853 0 C-N-CA 127.525 2.33 . . . . 0.0 107.269 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -63.09 -39.72 95.55 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 126.465 1.906 . . . . 0.0 115.55 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.9 mp -64.59 -53.98 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 177.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -63.55 -31.65 72.87 Favored 'General case' 0 CA--C 1.571 1.78 0 CA-C-O 117.902 -1.046 . . . . 0.0 110.881 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -68.36 -34.52 76.22 Favored 'General case' 0 CA--C 1.57 1.738 0 CA-C-N 120.363 1.438 . . . . 0.0 113.315 177.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -61.68 -51.58 67.83 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 177.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -80.02 -42.45 23.79 Favored 'General case' 0 CA--C 1.56 1.364 0 N-CA-C 116.903 2.186 . . . . 0.0 116.903 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -85.0 -35.14 22.15 Favored 'General case' 0 CA--C 1.561 1.366 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.2 mt 56.64 53.45 8.42 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 115.858 1.799 . . . . 0.0 115.858 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -82.19 -178.38 7.0 Favored 'General case' 0 CA--C 1.572 1.81 0 C-N-CA 125.079 1.352 . . . . 0.0 113.168 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? . . . . . 0 CA--C 1.56 1.338 0 O-C-N 121.019 -1.051 . . . . 0.0 111.877 179.987 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 102.835 -3.024 . . . . 0.0 102.835 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -142.41 55.53 1.44 Allowed 'General case' 0 CA--C 1.565 1.521 0 CA-C-O 122.364 1.078 . . . . 0.0 113.554 -179.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -141.75 -52.6 0.43 Allowed 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.765 1.626 . . . . 0.0 107.536 177.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt -76.95 29.26 0.13 Allowed 'General case' 0 CA--C 1.582 2.185 0 CA-C-N 119.726 1.148 . . . . 0.0 112.644 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.317 3.0 pp -81.73 -60.12 2.36 Favored 'General case' 0 CA--C 1.559 1.323 0 C-N-CA 125.675 1.59 . . . . 0.0 108.187 177.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.05 -42.29 14.98 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 125.599 1.56 . . . . 0.0 108.656 176.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -59.15 -38.34 79.46 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 116.591 -1.671 . . . . 0.0 112.537 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -65.37 -47.17 77.32 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 121.404 1.911 . . . . 0.0 110.207 176.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.317 0.5 OUTLIER -63.16 -17.24 19.21 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.45 0 C-N-CA 125.337 1.455 . . . . 0.0 113.983 177.301 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -92.47 -36.43 13.09 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 127.445 2.298 . . . . 0.0 107.614 176.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -65.09 -43.84 90.81 Favored 'General case' 0 CA--C 1.563 1.459 0 C-N-CA 126.433 1.893 . . . . 0.0 114.395 177.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -64.63 -50.84 73.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -62.2 -33.46 74.59 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.779 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -67.02 -34.49 77.84 Favored 'General case' 0 CA--C 1.571 1.762 0 CA-C-N 119.921 1.237 . . . . 0.0 113.475 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -61.89 -51.58 67.61 Favored 'General case' 0 CA--C 1.561 1.378 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -79.33 -43.35 23.72 Favored 'General case' 0 CA--C 1.562 1.408 0 N-CA-C 116.842 2.164 . . . . 0.0 116.842 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -86.24 -32.75 20.98 Favored 'General case' 0 CA--C 1.561 1.383 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.253 4.3 mt 56.89 53.05 8.56 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 116.106 1.891 . . . . 0.0 116.106 177.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -84.03 -179.19 7.19 Favored 'General case' 0 CA--C 1.573 1.834 0 C-N-CA 125.052 1.341 . . . . 0.0 112.934 177.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? . . . . . 0 CA--C 1.56 1.353 0 O-C-N 121.001 -1.062 . . . . 0.0 112.299 179.682 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 102.764 -3.051 . . . . 0.0 102.764 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -144.76 60.26 1.32 Allowed 'General case' 0 CA--C 1.556 1.193 0 CA-C-O 122.644 1.211 . . . . 0.0 111.694 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -144.7 -60.82 0.37 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 177.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.5 mtt -73.08 19.46 0.09 Allowed 'General case' 0 CA--C 1.575 1.924 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 177.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 76.3 mt -82.75 -77.42 0.24 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.543 1.937 . . . . 0.0 105.935 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 tttp -72.6 -33.63 66.82 Favored 'General case' 0 CA--C 1.565 1.541 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.862 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.66 -40.4 92.39 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 116.517 -1.706 . . . . 0.0 111.279 177.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -63.87 -45.68 88.32 Favored 'General case' 0 N--CA 1.501 2.102 0 CA-C-N 121.623 2.01 . . . . 0.0 110.855 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -63.3 -18.94 22.78 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.433 0 C-N-CA 125.157 1.383 . . . . 0.0 113.741 177.306 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -88.89 -39.69 13.62 Favored 'General case' 0 CA--C 1.572 1.821 0 C-N-CA 126.983 2.113 . . . . 0.0 107.211 176.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -65.55 -44.27 87.32 Favored 'General case' 0 CA--C 1.563 1.465 0 C-N-CA 126.355 1.862 . . . . 0.0 114.828 177.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.7 mp -65.88 -52.15 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -60.79 -31.69 71.06 Favored 'General case' 0 CA--C 1.571 1.783 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.248 176.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -69.66 -49.07 57.21 Favored 'General case' 0 CA--C 1.567 1.6 0 CA-C-N 119.638 1.108 . . . . 0.0 111.995 177.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -50.25 -57.46 7.76 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 177.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.252 6.9 pt20 -65.92 -32.28 73.69 Favored 'General case' 0 CA--C 1.561 1.395 0 N-CA-C 116.797 2.147 . . . . 0.0 116.797 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.3 t30 -68.73 -36.91 79.0 Favored 'General case' 0 CA--C 1.563 1.477 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 177.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.1 mt -60.84 -61.83 2.3 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.637 1.175 . . . . 0.0 113.728 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -83.59 -176.93 6.54 Favored 'General case' 0 CA--C 1.572 1.819 0 C-N-CA 124.63 1.172 . . . . 0.0 112.764 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 85.1 tttt . . . . . 0 CA--C 1.557 1.213 0 O-C-N 121.053 -1.029 . . . . 0.0 111.023 179.975 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 103.097 -2.927 . . . . 0.0 103.097 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -147.46 65.05 1.14 Allowed 'General case' 0 CA--C 1.562 1.421 0 CA-C-O 122.774 1.273 . . . . 0.0 111.812 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -153.02 -54.36 0.11 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.72 1.608 . . . . 0.0 107.264 177.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 32.9 mtm -77.65 30.1 0.16 Allowed 'General case' 0 CA--C 1.583 2.236 0 CA-C-N 119.627 1.103 . . . . 0.0 112.142 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.311 2.9 pp -81.89 -61.17 1.99 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 125.847 1.659 . . . . 0.0 108.109 177.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -84.5 -38.6 19.89 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 125.609 1.564 . . . . 0.0 109.822 176.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.09 -38.58 91.74 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 116.726 -1.606 . . . . 0.0 111.763 177.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -65.28 -46.29 81.06 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 121.36 1.891 . . . . 0.0 110.341 176.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.32 0.5 OUTLIER -63.27 -18.72 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.403 0 C-N-CA 125.161 1.384 . . . . 0.0 113.804 177.278 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -89.48 -37.91 14.42 Favored 'General case' 0 CA--C 1.572 1.818 0 C-N-CA 127.116 2.166 . . . . 0.0 107.426 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -66.06 -44.67 83.88 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 126.457 1.903 . . . . 0.0 114.546 177.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -66.07 -52.0 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 107.07 -1.455 . . . . 0.0 107.07 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -60.58 -30.57 69.89 Favored 'General case' 0 CA--C 1.572 1.805 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.329 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -69.93 -49.86 47.72 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-N 119.768 1.167 . . . . 0.0 111.609 177.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -49.67 -57.25 7.58 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 115.368 1.618 . . . . 0.0 115.368 177.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.253 12.7 pt20 -64.9 -33.31 75.7 Favored 'General case' 0 CA--C 1.562 1.416 0 N-CA-C 116.553 2.057 . . . . 0.0 116.553 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -68.06 -36.47 79.92 Favored 'General case' 0 CA--C 1.564 1.513 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.1 mt -58.73 -58.97 6.25 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.682 1.193 . . . . 0.0 113.721 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -88.49 33.54 0.76 Allowed 'General case' 0 CA--C 1.572 1.797 0 N-CA-C 115.483 1.661 . . . . 0.0 115.483 177.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 84.5 tttt . . . . . 0 CA--C 1.56 1.329 0 O-C-N 120.947 -1.095 . . . . 0.0 112.892 -179.946 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.14 0 N-CA-C 102.803 -3.036 . . . . 0.0 102.803 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -145.45 60.2 1.28 Allowed 'General case' 0 CA--C 1.557 1.23 0 CA-C-O 122.607 1.194 . . . . 0.0 111.64 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -144.31 -59.74 0.38 Allowed 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 106.255 -1.758 . . . . 0.0 106.255 177.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.9 mtt -71.92 17.08 0.1 Allowed 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 177.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.8 mt -83.82 -75.52 0.33 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.938 2.095 . . . . 0.0 105.671 177.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -72.55 -33.76 67.05 Favored 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.121 176.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -66.87 -39.01 87.39 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-O 116.34 -1.79 . . . . 0.0 111.16 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -63.69 -46.35 85.93 Favored 'General case' 0 N--CA 1.501 2.107 0 CA-C-N 121.857 2.117 . . . . 0.0 110.561 176.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.321 0.5 OUTLIER -63.45 -15.91 17.13 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.438 0 C-N-CA 125.286 1.434 . . . . 0.0 114.349 177.376 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -92.98 -40.95 10.27 Favored 'General case' 0 CA--C 1.571 1.783 0 C-N-CA 127.452 2.301 . . . . 0.0 106.717 176.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -62.28 -41.83 98.82 Favored 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 126.453 1.901 . . . . 0.0 115.004 177.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.277 1.8 mp -65.78 -51.89 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -60.56 -31.72 70.82 Favored 'General case' 0 CA--C 1.572 1.804 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.414 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.9 tmmm? -70.17 -51.04 34.32 Favored 'General case' 0 CA--C 1.568 1.635 0 CA-C-N 119.305 0.957 . . . . 0.0 111.524 177.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -49.51 -57.57 6.8 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 114.911 1.449 . . . . 0.0 114.911 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.263 10.7 pt20 -62.98 -31.81 73.01 Favored 'General case' 0 CA--C 1.562 1.431 0 N-CA-C 116.034 1.865 . . . . 0.0 116.034 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -68.43 -34.6 76.28 Favored 'General case' 0 CA--C 1.565 1.531 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 177.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.1 mt -55.11 -61.57 2.23 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 177.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -75.22 -56.86 4.31 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 124.972 1.309 . . . . 0.0 113.671 177.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? . . . . . 0 CA--C 1.554 1.117 0 C-N-CA 124.098 0.959 . . . . 0.0 108.943 178.416 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 N-CA-C 104.373 -2.455 . . . . 0.0 104.373 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.51 57.01 1.65 Allowed 'General case' 0 CA--C 1.558 1.284 0 CA-C-O 122.532 1.158 . . . . 0.0 112.584 -179.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 10.8 p-10 -139.32 -56.5 0.59 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.384 1.474 . . . . 0.0 108.109 177.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.7 mtt -75.56 19.15 0.2 Allowed 'General case' 0 CA--C 1.577 1.984 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 177.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.6 mt -86.24 -74.71 0.41 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.13 2.172 . . . . 0.0 106.103 177.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -69.6 -34.77 74.57 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.846 176.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.26 -39.56 89.54 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-O 116.309 -1.805 . . . . 0.0 110.654 177.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -62.78 -46.98 85.47 Favored 'General case' 0 N--CA 1.501 2.079 0 CA-C-N 121.764 2.075 . . . . 0.0 110.525 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.61 -14.23 14.36 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.405 0 C-N-CA 125.304 1.442 . . . . 0.0 114.659 177.427 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -95.21 -38.36 10.61 Favored 'General case' 0 CA--C 1.575 1.927 0 C-N-CA 127.609 2.364 . . . . 0.0 107.029 176.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -63.19 -40.74 98.36 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 126.629 1.972 . . . . 0.0 115.422 177.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.8 mp -65.32 -54.32 30.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 177.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -62.54 -28.38 69.82 Favored 'General case' 0 CA--C 1.574 1.886 0 CA-C-O 117.813 -1.089 . . . . 0.0 111.459 176.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -71.03 -47.68 57.21 Favored 'General case' 0 CA--C 1.568 1.64 0 CA-C-N 119.922 1.237 . . . . 0.0 112.023 177.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -50.83 -54.32 24.74 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 177.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -78.05 -28.77 49.01 Favored 'General case' 0 CA--C 1.566 1.585 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -148.73 82.03 1.45 Allowed 'General case' 0 CA--C 1.566 1.595 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.0 mt -46.6 -41.87 15.23 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 116.926 2.195 . . . . 0.0 116.926 177.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -61.47 -45.44 94.23 Favored 'General case' 0 CA--C 1.566 1.594 0 C-N-CA 125.948 1.699 . . . . 0.0 114.665 177.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 86.6 tttt . . . . . 0 CA--C 1.557 1.237 0 C-N-CA 124.68 1.192 . . . . 0.0 110.471 178.016 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.453 0 N-CA-C 106.141 -1.8 . . . . 0.0 106.141 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.3 mmt -139.64 60.26 1.57 Allowed 'General case' 0 CA--C 1.563 1.454 0 C-N-CA 125.285 1.434 . . . . 0.0 110.901 -179.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -136.56 -53.09 0.72 Allowed 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.796 1.638 . . . . 0.0 107.782 177.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt -76.98 29.4 0.13 Allowed 'General case' 0 CA--C 1.583 2.218 0 CA-C-N 119.562 1.074 . . . . 0.0 112.666 176.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.321 3.2 pp -82.48 -60.16 2.29 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 125.536 1.534 . . . . 0.0 107.9 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.65 -37.75 20.65 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 125.552 1.541 . . . . 0.0 109.853 176.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.63 -39.15 93.64 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 116.925 -1.512 . . . . 0.0 111.62 177.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -64.59 -46.37 82.99 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 121.164 1.802 . . . . 0.0 110.644 176.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -63.35 -19.37 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.457 0 C-N-CA 125.149 1.38 . . . . 0.0 113.569 177.261 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -88.96 -36.59 15.79 Favored 'General case' 0 CA--C 1.573 1.858 0 C-N-CA 127.094 2.158 . . . . 0.0 107.678 176.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -66.11 -45.21 81.94 Favored 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 126.488 1.915 . . . . 0.0 114.338 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.281 1.9 mp -66.96 -51.49 54.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 177.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -60.26 -29.88 69.07 Favored 'General case' 0 CA--C 1.572 1.824 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.117 176.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -64.77 -61.39 2.21 Favored 'General case' 0 CA--C 1.567 1.622 0 CA-C-N 119.515 1.052 . . . . 0.0 110.526 177.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -47.16 -49.67 22.06 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 117.41 2.374 . . . . 0.0 117.41 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.288 4.9 tp-100 -49.9 -43.85 49.77 Favored 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 126.627 1.971 . . . . 0.0 115.303 177.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . 0.263 40.3 t30 135.8 91.48 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 127.08 2.152 . . . . 0.0 106.848 177.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.8 mt -55.95 -33.66 64.95 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 117.522 2.416 . . . . 0.0 117.522 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -69.18 -178.56 1.33 Allowed 'General case' 0 CA--C 1.574 1.883 0 C-N-CA 125.347 1.459 . . . . 0.0 114.187 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.2 tttm . . . . . 0 CA--C 1.561 1.379 0 O-C-N 120.776 -1.203 . . . . 0.0 112.709 -179.988 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 CA--C 1.552 1.029 0 N-CA-C 104.088 -2.56 . . . . 0.0 104.088 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 ttp 61.93 54.55 2.79 Favored 'General case' 0 CA--C 1.559 1.291 0 N-CA-C 116.269 1.951 . . . . 0.0 116.269 177.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . 0.284 12.1 p-10 -159.57 -69.54 0.08 Allowed 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.9 mtt -74.12 18.05 0.16 Allowed 'General case' 0 CA--C 1.573 1.865 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 177.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.6 mt -86.31 -74.6 0.41 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.464 1.906 . . . . 0.0 106.147 177.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -70.6 -34.05 71.73 Favored 'General case' 0 CA--C 1.563 1.451 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.959 176.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.92 -39.45 87.38 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 116.449 -1.739 . . . . 0.0 110.792 177.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -63.17 -46.75 85.7 Favored 'General case' 0 N--CA 1.501 2.1 0 CA-C-N 121.753 2.07 . . . . 0.0 110.698 176.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.02 -17.57 19.69 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.374 0 C-N-CA 125.26 1.424 . . . . 0.0 114.084 177.35 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -91.36 -39.12 12.2 Favored 'General case' 0 CA--C 1.57 1.738 0 C-N-CA 127.16 2.184 . . . . 0.0 107.182 176.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -62.02 -44.46 96.68 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 126.597 1.959 . . . . 0.0 115.311 177.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -64.32 -51.33 69.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 177.305 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -61.95 -33.4 74.22 Favored 'General case' 0 CA--C 1.57 1.733 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.973 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -68.82 -34.67 75.89 Favored 'General case' 0 CA--C 1.568 1.656 0 CA-C-N 119.946 1.248 . . . . 0.0 113.646 177.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -62.91 -50.79 69.47 Favored 'General case' 0 CA--C 1.562 1.423 0 N-CA-C 115.162 1.542 . . . . 0.0 115.162 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -79.45 -43.79 22.58 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 116.784 2.142 . . . . 0.0 116.784 -179.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -85.73 -36.61 20.08 Favored 'General case' 0 CA--C 1.563 1.456 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.258 3.5 mt 59.98 52.69 5.07 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 177.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.7 p90 -73.88 -43.08 59.65 Favored 'General case' 0 CA--C 1.56 1.358 0 N-CA-C 115.753 1.761 . . . . 0.0 115.753 177.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.0 tttp . . . . . 0 CA--C 1.556 1.2 0 CA-C-O 121.99 0.9 . . . . 0.0 110.837 -179.964 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.151 0 N-CA-C 103.192 -2.892 . . . . 0.0 103.192 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.3 63.17 1.28 Allowed 'General case' 0 CA--C 1.563 1.456 0 CA-C-O 122.8 1.285 . . . . 0.0 112.015 -179.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -144.24 -51.93 0.31 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 125.681 1.593 . . . . 0.0 107.705 177.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.2 ptp -78.47 29.33 0.19 Allowed 'General case' 0 CA--C 1.581 2.158 0 CA-C-N 119.785 1.175 . . . . 0.0 112.599 176.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.319 3.0 pp -82.45 -61.39 1.9 Allowed 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 125.811 1.644 . . . . 0.0 107.471 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.4 tttp -84.79 -37.62 20.57 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 125.49 1.516 . . . . 0.0 109.537 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.96 -38.84 92.72 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 116.583 -1.675 . . . . 0.0 111.519 177.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -64.12 -46.81 82.52 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 121.423 1.919 . . . . 0.0 110.093 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.318 0.5 OUTLIER -64.36 -11.89 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.481 0 C-N-CA 125.319 1.448 . . . . 0.0 114.6 177.285 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -98.34 -37.32 9.68 Favored 'General case' 0 CA--C 1.575 1.906 0 C-N-CA 127.913 2.485 . . . . 0.0 107.26 176.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -64.57 -41.25 96.41 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 126.577 1.951 . . . . 0.0 115.645 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.277 1.8 mp -64.68 -52.16 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 124.383 1.073 . . . . 0.0 108.105 177.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -64.05 -32.81 74.49 Favored 'General case' 0 CA--C 1.571 1.774 0 CA-C-O 117.792 -1.099 . . . . 0.0 110.67 176.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -65.8 -41.04 92.42 Favored 'General case' 0 CA--C 1.567 1.61 0 CA-C-N 120.057 1.299 . . . . 0.0 114.179 177.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -32.95 -46.38 0.15 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 119.252 3.056 . . . . 0.0 119.252 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -73.05 15.5 0.21 Allowed 'General case' 0 CA--C 1.575 1.914 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . 0.362 15.4 p30 63.43 65.98 0.72 Allowed 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 127.132 2.173 . . . . 0.0 112.841 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.7 mt -61.96 -52.99 61.78 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 177.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -75.92 177.36 7.06 Favored 'General case' 0 CA--C 1.573 1.851 0 C-N-CA 125.197 1.399 . . . . 0.0 113.347 178.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 85.3 tttt . . . . . 0 CA--C 1.556 1.195 0 O-C-N 120.959 -1.088 . . . . 0.0 110.559 179.07 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 102.854 -3.017 . . . . 0.0 102.854 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.72 61.25 1.33 Allowed 'General case' 0 CA--C 1.558 1.265 0 CA-C-O 122.807 1.289 . . . . 0.0 110.92 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -143.56 -58.08 0.4 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 177.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.3 mtp -67.78 5.31 0.88 Allowed 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 116.875 2.176 . . . . 0.0 116.875 177.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.1 mt -79.55 -78.26 0.16 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.844 2.057 . . . . 0.0 108.629 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -72.37 -33.24 67.1 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-O 117.707 -1.139 . . . . 0.0 112.588 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . 0.262 0.2 OUTLIER -67.42 -41.22 85.2 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 116.93 -1.51 . . . . 0.0 111.306 177.386 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -62.23 -46.31 89.42 Favored 'General case' 0 N--CA 1.501 2.117 0 CA-C-N 120.639 1.563 . . . . 0.0 111.267 176.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.325 0.5 OUTLIER -62.7 -21.44 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.323 0 C-N-CA 125.149 1.38 . . . . 0.0 113.665 177.325 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -87.14 -37.5 17.29 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 126.618 1.967 . . . . 0.0 107.54 176.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -64.07 -44.86 91.12 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 126.467 1.907 . . . . 0.0 114.638 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.272 1.8 mp -65.71 -52.47 49.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -61.15 -28.28 69.0 Favored 'General case' 0 CA--C 1.572 1.815 0 CA-C-O 118.006 -0.997 . . . . 0.0 111.789 176.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -72.47 -46.85 52.95 Favored 'General case' 0 CA--C 1.567 1.62 0 CA-C-N 119.929 1.241 . . . . 0.0 111.762 177.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -50.76 -54.18 25.6 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 114.363 1.246 . . . . 0.0 114.363 177.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -79.6 -21.48 44.93 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 116.239 1.94 . . . . 0.0 116.239 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -151.84 81.27 1.27 Allowed 'General case' 0 CA--C 1.568 1.644 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 12.6 mt -50.69 -35.88 33.21 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 117.463 2.394 . . . . 0.0 117.463 177.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 34.2 p90 -83.01 60.74 5.63 Favored 'General case' 0 CA--C 1.574 1.892 0 C-N-CA 126.249 1.82 . . . . 0.0 111.901 177.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.1 tttm . . . . . 0 CA--C 1.559 1.303 0 O-C-N 121.191 -0.943 . . . . 0.0 112.871 -179.84 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 102.942 -2.985 . . . . 0.0 102.942 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.38 63.16 1.33 Allowed 'General case' 0 CA--C 1.563 1.457 0 CA-C-O 122.909 1.338 . . . . 0.0 111.301 -179.346 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -142.01 -50.88 0.4 Allowed 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 125.896 1.679 . . . . 0.0 107.635 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 18.8 ptt? -78.92 29.59 0.21 Allowed 'General case' 0 CA--C 1.583 2.24 0 CA-C-N 119.838 1.199 . . . . 0.0 112.444 176.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.32 3.1 pp -83.16 -61.45 1.85 Allowed 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 125.827 1.651 . . . . 0.0 107.468 177.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -82.98 -37.25 24.29 Favored 'General case' 0 CA--C 1.561 1.402 0 C-N-CA 125.225 1.41 . . . . 0.0 109.641 176.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -63.01 -39.24 94.17 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 116.743 -1.598 . . . . 0.0 111.262 177.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -63.93 -46.76 83.3 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 121.23 1.832 . . . . 0.0 109.981 176.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.317 0.5 OUTLIER -65.26 -9.66 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.482 0 C-N-CA 125.323 1.449 . . . . 0.0 114.748 177.285 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -99.73 -37.37 9.13 Favored 'General case' 0 CA--C 1.577 1.99 0 C-N-CA 128.272 2.629 . . . . 0.0 107.066 176.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -65.5 -41.29 93.4 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 126.632 1.973 . . . . 0.0 115.278 177.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.276 1.8 mp -64.95 -53.52 40.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -61.98 -31.27 71.62 Favored 'General case' 0 CA--C 1.572 1.8 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.897 176.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -67.93 -50.69 54.56 Favored 'General case' 0 CA--C 1.567 1.628 0 CA-C-N 119.875 1.216 . . . . 0.0 111.664 177.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -49.12 -58.04 5.63 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 177.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.265 11.6 pt20 -63.0 -33.31 75.16 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 -179.493 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -71.88 -28.3 63.43 Favored 'General case' 0 CA--C 1.563 1.456 0 N-CA-C 114.669 1.359 . . . . 0.0 114.669 177.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.1 mt -60.41 -61.34 2.67 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 120.002 1.274 . . . . 0.0 113.77 177.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -73.26 -54.16 9.1 Favored 'General case' 0 CA--C 1.56 1.34 0 C-N-CA 124.612 1.165 . . . . 0.0 113.733 177.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? . . . . . 0 CA--C 1.553 1.095 0 C-N-CA 124.118 0.967 . . . . 0.0 108.775 177.996 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 103.65 -2.722 . . . . 0.0 103.65 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.8 ptt? -142.86 62.9 1.4 Allowed 'General case' 0 CA--C 1.557 1.218 0 CA-C-O 122.903 1.335 . . . . 0.0 111.87 -179.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -149.47 -61.78 0.22 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 105.797 -1.927 . . . . 0.0 105.797 177.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.8 mtt -71.19 17.46 0.08 Allowed 'General case' 0 CA--C 1.576 1.955 0 N-CA-C 115.894 1.813 . . . . 0.0 115.894 177.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 74.4 mt -80.59 -76.96 0.21 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.758 2.023 . . . . 0.0 105.666 177.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -75.58 -33.59 60.6 Favored 'General case' 0 CA--C 1.564 1.512 0 CA-C-O 117.806 -1.092 . . . . 0.0 110.789 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.29 -39.7 92.89 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 116.455 -1.736 . . . . 0.0 111.701 177.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -64.22 -45.96 85.94 Favored 'General case' 0 N--CA 1.501 2.101 0 CA-C-N 121.679 2.036 . . . . 0.0 110.669 176.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.48 -17.39 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.443 0 C-N-CA 125.279 1.432 . . . . 0.0 114.01 177.361 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -90.91 -40.09 11.91 Favored 'General case' 0 CA--C 1.57 1.722 0 C-N-CA 127.283 2.233 . . . . 0.0 107.069 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -63.2 -43.94 96.74 Favored 'General case' 0 CA--C 1.561 1.403 0 C-N-CA 126.414 1.886 . . . . 0.0 115.086 177.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.281 1.8 mp -65.93 -52.57 47.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 177.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.6 -30.19 69.67 Favored 'General case' 0 CA--C 1.572 1.806 0 CA-C-O 118.44 -0.79 . . . . 0.0 111.693 176.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -70.88 -51.39 26.64 Favored 'General case' 0 CA--C 1.565 1.521 0 CA-C-N 119.37 0.987 . . . . 0.0 111.46 177.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -48.51 -53.1 19.36 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -74.31 -28.39 61.15 Favored 'General case' 0 CA--C 1.566 1.561 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -138.07 68.42 1.4 Allowed 'General case' 0 CA--C 1.567 1.612 0 C-N-CA 124.141 0.977 . . . . 0.0 109.863 177.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 12.8 mt -56.16 -40.05 73.28 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 116.966 2.21 . . . . 0.0 116.966 177.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 49.7 p90 -68.13 176.38 2.72 Favored 'General case' 0 CA--C 1.575 1.905 0 C-N-CA 125.722 1.609 . . . . 0.0 114.11 177.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.3 tttm . . . . . 0 CA--C 1.557 1.228 0 O-C-N 121.001 -1.062 . . . . 0.0 110.688 179.055 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . 0.283 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.797 0 N-CA-C 101.481 -3.525 . . . . 0.0 101.481 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 13.1 mmt 55.8 57.27 5.34 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 115.672 1.731 . . . . 0.0 115.672 177.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . 0.275 13.2 p-10 -160.56 -66.14 0.07 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 177.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 33.1 mtm -72.92 13.87 0.34 Allowed 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 115.864 1.802 . . . . 0.0 115.864 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 84.3 mt -89.76 -69.81 0.7 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.361 2.264 . . . . 0.0 105.353 177.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -67.68 -35.51 78.97 Favored 'General case' 0 CA--C 1.563 1.469 0 C-N-CA 124.014 0.926 . . . . 0.0 111.661 176.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.74 -39.9 80.13 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 116.501 -1.714 . . . . 0.0 109.967 176.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -62.1 -46.79 87.51 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-N 121.542 1.974 . . . . 0.0 110.962 176.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.324 0.5 OUTLIER -62.48 -21.64 27.67 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.381 0 C-N-CA 125.174 1.39 . . . . 0.0 113.687 177.35 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -86.48 -37.84 17.88 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 126.692 1.997 . . . . 0.0 107.623 176.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -64.95 -44.77 88.32 Favored 'General case' 0 CA--C 1.562 1.416 0 C-N-CA 126.418 1.887 . . . . 0.0 114.701 177.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.8 mp -66.17 -52.2 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 177.394 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -60.87 -30.06 69.92 Favored 'General case' 0 CA--C 1.572 1.821 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.391 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -68.94 -53.02 23.2 Favored 'General case' 0 CA--C 1.565 1.548 0 CA-C-N 119.725 1.148 . . . . 0.0 110.881 177.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -50.86 -50.78 56.13 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.256 3.9 tp-100 -63.09 -45.5 91.79 Favored 'General case' 0 CA--C 1.564 1.481 0 C-N-CA 126.527 1.931 . . . . 0.0 115.51 177.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -129.93 67.0 1.47 Allowed 'General case' 0 CA--C 1.564 1.513 0 C-N-CA 124.272 1.029 . . . . 0.0 112.0 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 12.0 mt -53.92 -49.63 68.19 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 115.541 1.682 . . . . 0.0 115.541 177.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.9 p90 -87.2 60.14 5.98 Favored 'General case' 0 CA--C 1.57 1.741 0 C-N-CA 126.335 1.854 . . . . 0.0 112.24 177.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.5 tttp . . . . . 0 N--CA 1.483 1.222 0 O-C-N 120.903 -1.123 . . . . 0.0 111.569 -179.806 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 103.937 -2.616 . . . . 0.0 103.937 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.27 55.02 1.76 Allowed 'General case' 0 CA--C 1.558 1.266 0 CA-C-O 122.405 1.098 . . . . 0.0 112.946 -179.271 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -137.82 -59.65 0.65 Allowed 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.5 mtt -71.89 17.14 0.1 Allowed 'General case' 0 CA--C 1.575 1.91 0 N-CA-C 116.094 1.886 . . . . 0.0 116.094 177.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 81.2 mt -83.9 -75.22 0.34 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.76 2.024 . . . . 0.0 105.717 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -72.53 -33.93 67.2 Favored 'General case' 0 CA--C 1.561 1.391 0 CA-C-O 117.955 -1.022 . . . . 0.0 111.07 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -66.73 -39.21 87.89 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 116.502 -1.713 . . . . 0.0 111.216 177.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -63.79 -46.3 85.81 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 121.695 2.043 . . . . 0.0 110.799 176.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -62.75 -20.22 24.82 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.369 0 C-N-CA 125.154 1.382 . . . . 0.0 113.746 177.292 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -87.82 -38.87 15.33 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 126.937 2.095 . . . . 0.0 107.347 176.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -64.54 -44.87 89.46 Favored 'General case' 0 CA--C 1.561 1.378 0 C-N-CA 126.351 1.86 . . . . 0.0 114.992 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.8 mp -65.69 -52.19 53.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.412 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -60.76 -31.72 71.05 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.367 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -69.79 -49.5 52.22 Favored 'General case' 0 CA--C 1.564 1.516 0 CA-C-N 119.737 1.153 . . . . 0.0 111.877 177.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -47.02 -53.92 11.4 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 115.787 1.773 . . . . 0.0 115.787 177.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.25 7.3 pt20 -70.43 -32.9 70.68 Favored 'General case' 0 CA--C 1.56 1.363 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -179.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 29.2 p30 -71.69 -27.45 63.05 Favored 'General case' 0 CA--C 1.562 1.425 0 N-CA-C 116.894 2.183 . . . . 0.0 116.894 177.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.0 mt -55.92 -47.77 76.9 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -85.99 56.33 3.93 Favored 'General case' 0 CA--C 1.57 1.745 0 C-N-CA 125.013 1.325 . . . . 0.0 113.953 178.012 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.6 tttm . . . . . 0 N--CA 1.483 1.193 0 O-C-N 120.871 -1.143 . . . . 0.0 110.89 -179.974 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.134 0 N-CA-C 102.347 -3.205 . . . . 0.0 102.347 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.425 ' O ' ' SD ' ' A' ' 2' ' ' MET . 4.3 ppp? -144.48 51.95 1.26 Allowed 'General case' 0 CA--C 1.557 1.246 0 CA-C-O 122.227 1.013 . . . . 0.0 113.558 -179.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -138.91 -60.05 0.59 Allowed 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.3 mtp -72.1 17.21 0.1 Allowed 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 177.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 73.9 mt -81.17 -78.09 0.19 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.673 1.989 . . . . 0.0 106.306 177.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -72.93 -33.78 66.15 Favored 'General case' 0 CA--C 1.563 1.466 0 CA-C-O 117.769 -1.11 . . . . 0.0 110.894 176.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -64.69 -40.66 95.76 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 116.636 -1.65 . . . . 0.0 111.448 177.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -63.86 -46.3 85.61 Favored 'General case' 0 N--CA 1.501 2.121 0 CA-C-N 121.428 1.922 . . . . 0.0 110.785 176.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -62.83 -19.94 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.395 0 C-N-CA 125.255 1.422 . . . . 0.0 113.812 177.298 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -88.14 -37.12 16.44 Favored 'General case' 0 CA--C 1.573 1.839 0 C-N-CA 126.91 2.084 . . . . 0.0 107.508 176.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -65.6 -44.87 85.28 Favored 'General case' 0 CA--C 1.563 1.477 0 C-N-CA 126.428 1.891 . . . . 0.0 114.387 177.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -66.1 -51.71 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -60.22 -31.89 70.6 Favored 'General case' 0 CA--C 1.57 1.749 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.123 176.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -67.39 -51.63 49.56 Favored 'General case' 0 CA--C 1.567 1.62 0 CA-C-N 119.799 1.182 . . . . 0.0 111.762 177.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -48.89 -58.9 4.11 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.251 7.4 pt20 -62.68 -33.99 76.21 Favored 'General case' 0 CA--C 1.558 1.265 0 N-CA-C 117.076 2.25 . . . . 0.0 117.076 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -71.59 -27.89 63.44 Favored 'General case' 0 CA--C 1.561 1.393 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.0 mt -62.14 -62.06 2.04 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 120.114 1.324 . . . . 0.0 113.695 177.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -72.42 -55.15 7.5 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 124.605 1.162 . . . . 0.0 113.897 177.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 84.5 tttt . . . . . 0 CA--C 1.554 1.097 0 C-N-CA 124.121 0.969 . . . . 0.0 109.439 178.722 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 102.623 -3.103 . . . . 0.0 102.623 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.09 66.34 1.2 Allowed 'General case' 0 CA--C 1.564 1.491 0 CA-C-O 123.243 1.497 . . . . 0.0 111.084 -179.363 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -153.04 -54.07 0.11 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 125.863 1.665 . . . . 0.0 106.801 177.781 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 30.4 mtp -75.81 26.98 0.11 Allowed 'General case' 0 CA--C 1.583 2.22 0 CA-C-N 119.711 1.141 . . . . 0.0 113.002 176.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.312 2.8 pp -80.75 -61.51 1.95 Allowed 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 125.935 1.694 . . . . 0.0 107.906 177.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -86.67 -37.5 17.94 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.578 1.551 . . . . 0.0 109.5 176.925 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -63.0 -38.58 91.77 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-O 116.782 -1.58 . . . . 0.0 111.973 177.313 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -65.75 -46.15 79.94 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 121.339 1.881 . . . . 0.0 110.328 176.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.319 0.5 OUTLIER -64.06 -16.35 18.68 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.424 0 C-N-CA 125.201 1.4 . . . . 0.0 113.757 177.193 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -91.27 -39.11 12.26 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 127.452 2.301 . . . . 0.0 107.24 176.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -65.01 -47.91 75.8 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 126.406 1.882 . . . . 0.0 115.187 177.636 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.267 1.8 mp -65.93 -51.3 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 177.534 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -60.14 -32.64 71.21 Favored 'General case' 0 CA--C 1.567 1.634 0 CA-C-O 117.612 -1.185 . . . . 0.0 111.252 176.512 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -68.14 -52.16 37.84 Favored 'General case' 0 CA--C 1.567 1.607 0 CA-C-N 120.152 1.342 . . . . 0.0 111.679 177.214 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -46.76 -50.78 17.63 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 116.206 1.928 . . . . 0.0 116.206 177.795 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.271 12.2 pt20 -71.59 -36.28 70.81 Favored 'General case' 0 CA--C 1.559 1.313 0 N-CA-C 116.432 2.012 . . . . 0.0 116.432 -179.541 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.0 -19.4 63.33 Favored 'General case' 0 CA--C 1.567 1.598 0 N-CA-C 116.842 2.164 . . . . 0.0 116.842 177.703 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 23.2 mt -77.01 75.45 3.58 Favored 'General case' 0 CA--C 1.568 1.661 0 C-N-CA 124.428 1.091 . . . . 0.0 112.408 -179.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -85.45 -69.16 0.68 Allowed 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.436 -0.79 . . . . 0.0 113.025 -179.672 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 7.9 tmtm? . . . . . 0 N--CA 1.485 1.277 0 C-N-CA 123.792 0.837 . . . . 0.0 112.064 -179.902 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt . . . . . 0 CA--C 1.583 2.223 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.315 2.9 pp -81.31 -61.2 2.01 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 126.011 1.724 . . . . 0.0 107.917 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -85.28 -40.75 16.23 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 125.684 1.593 . . . . 0.0 108.865 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -59.99 -38.57 82.99 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 116.643 -1.646 . . . . 0.0 112.277 177.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -65.18 -47.34 77.31 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 121.375 1.898 . . . . 0.0 110.19 176.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.315 0.5 OUTLIER -63.18 -17.34 19.42 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.463 0 C-N-CA 125.304 1.442 . . . . 0.0 113.967 177.355 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -92.16 -37.27 12.82 Favored 'General case' 0 CA--C 1.571 1.775 0 C-N-CA 127.365 2.266 . . . . 0.0 107.364 176.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -64.1 -43.49 95.22 Favored 'General case' 0 CA--C 1.562 1.424 0 C-N-CA 126.462 1.905 . . . . 0.0 114.616 177.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -64.65 -51.1 71.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.262 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -62.1 -33.11 73.84 Favored 'General case' 0 CA--C 1.571 1.759 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.928 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt . . . . . 0 CA--C 1.569 1.711 0 CA-C-N 119.755 1.161 . . . . 0.0 113.568 177.281 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.7 mtt . . . . . 0 CA--C 1.575 1.916 0 N-CA-C 115.767 1.765 . . . . 0.0 115.767 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 76.8 mt -83.01 -77.25 0.25 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.494 1.918 . . . . 0.0 105.972 177.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -72.64 -34.07 67.03 Favored 'General case' 0 CA--C 1.565 1.523 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.836 176.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -65.66 -39.71 91.65 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-O 116.315 -1.802 . . . . 0.0 111.46 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.0 t30 -63.88 -45.26 90.21 Favored 'General case' 0 N--CA 1.501 2.123 0 CA-C-N 121.873 2.124 . . . . 0.0 110.6 176.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.321 0.5 OUTLIER -65.47 -10.43 10.05 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.501 0 C-N-CA 125.354 1.462 . . . . 0.0 114.587 177.306 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -99.3 -39.05 8.61 Favored 'General case' 0 CA--C 1.573 1.861 0 C-N-CA 128.108 2.563 . . . . 0.0 107.193 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -64.78 -44.84 88.71 Favored 'General case' 0 CA--C 1.561 1.371 0 C-N-CA 126.54 1.936 . . . . 0.0 115.123 177.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -65.5 -51.29 65.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 177.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.4 mm-40 -61.29 -31.16 70.99 Favored 'General case' 0 CA--C 1.57 1.742 0 CA-C-O 118.339 -0.838 . . . . 0.0 111.289 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 CA--C 1.565 1.555 0 CA-C-N 119.454 1.025 . . . . 0.0 111.337 177.174 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 18.8 ptt? . . . . . 0 CA--C 1.583 2.23 0 CA-C-O 120.871 0.367 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.31 2.9 pp -82.41 -60.95 2.03 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 125.811 1.644 . . . . 0.0 107.795 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -84.64 -38.79 19.41 Favored 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 125.712 1.605 . . . . 0.0 109.665 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.11 -38.43 91.16 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 116.469 -1.729 . . . . 0.0 111.658 177.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -64.53 -45.93 85.06 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-N 121.608 2.004 . . . . 0.0 109.945 176.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -65.92 -7.74 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.545 0 C-N-CA 125.329 1.451 . . . . 0.0 114.799 177.319 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -102.85 -36.9 8.07 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 128.397 2.679 . . . . 0.0 107.193 176.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -65.5 -41.17 93.51 Favored 'General case' 0 CA--C 1.56 1.356 0 C-N-CA 126.546 1.938 . . . . 0.0 115.545 177.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.28 1.8 mp -64.79 -53.55 40.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.533 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -62.24 -30.88 71.41 Favored 'General case' 0 CA--C 1.572 1.794 0 CA-C-O 117.99 -1.005 . . . . 0.0 111.129 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt . . . . . 0 CA--C 1.569 1.685 0 CA-C-N 119.905 1.229 . . . . 0.0 112.258 177.138 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.6 mtt . . . . . 0 CA--C 1.575 1.921 0 N-CA-C 115.839 1.792 . . . . 0.0 115.839 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 81.7 mt -84.13 -75.37 0.34 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.779 2.032 . . . . 0.0 105.961 177.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -71.73 -34.67 69.74 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 118.082 -0.961 . . . . 0.0 111.01 176.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.18 -39.52 89.77 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 116.341 -1.79 . . . . 0.0 111.13 177.141 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -63.63 -45.88 88.24 Favored 'General case' 0 N--CA 1.501 2.105 0 CA-C-N 121.842 2.11 . . . . 0.0 110.642 176.508 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -64.6 -12.92 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 C-N-CA 125.251 1.42 . . . . 0.0 114.469 177.316 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -96.3 -39.49 9.61 Favored 'General case' 0 CA--C 1.573 1.828 0 C-N-CA 127.71 2.404 . . . . 0.0 107.028 176.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -64.23 -44.21 92.58 Favored 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 126.598 1.959 . . . . 0.0 115.072 177.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.8 mp -64.37 -51.42 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 177.389 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.2 mm-40 -62.32 -32.97 73.8 Favored 'General case' 0 CA--C 1.57 1.733 0 CA-C-O 118.289 -0.862 . . . . 0.0 110.911 176.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt . . . . . 0 CA--C 1.571 1.752 0 CA-C-N 119.818 1.19 . . . . 0.0 113.182 177.155 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.1 mtt . . . . . 0 CA--C 1.58 2.131 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.321 3.0 pp -81.03 -60.61 2.23 Favored 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 125.531 1.532 . . . . 0.0 107.684 177.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -87.27 -37.77 16.9 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 125.591 1.556 . . . . 0.0 109.435 176.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -62.64 -38.52 90.58 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 116.508 -1.711 . . . . 0.0 111.729 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -64.61 -46.52 82.3 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 121.552 1.978 . . . . 0.0 109.977 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.319 0.5 OUTLIER -65.13 -9.99 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 C-N-CA 125.311 1.444 . . . . 0.0 114.707 177.269 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -100.24 -37.05 9.07 Favored 'General case' 0 CA--C 1.575 1.94 0 C-N-CA 128.223 2.609 . . . . 0.0 107.195 176.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -65.01 -40.97 95.69 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 126.544 1.938 . . . . 0.0 115.558 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.276 1.9 mp -65.35 -53.86 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 177.499 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -62.23 -29.0 70.08 Favored 'General case' 0 CA--C 1.572 1.81 0 CA-C-O 117.69 -1.148 . . . . 0.0 111.344 176.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.7 ttpt . . . . . 0 CA--C 1.57 1.73 0 CA-C-N 120.097 1.317 . . . . 0.0 112.101 177.102 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.7 mtt . . . . . 0 CA--C 1.574 1.894 0 N-CA-C 115.956 1.835 . . . . 0.0 115.956 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 73.1 mt -81.78 -77.02 0.23 Allowed 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 177.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -74.42 -33.78 63.07 Favored 'General case' 0 CA--C 1.565 1.537 0 CA-C-O 118.077 -0.963 . . . . 0.0 110.84 176.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.68 -39.7 91.58 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 116.287 -1.816 . . . . 0.0 111.399 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -63.31 -46.61 85.9 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-N 121.891 2.132 . . . . 0.0 110.43 176.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.62 -14.2 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.383 0 C-N-CA 125.301 1.44 . . . . 0.0 114.52 177.433 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -96.56 -36.56 10.71 Favored 'General case' 0 CA--C 1.573 1.853 0 C-N-CA 127.525 2.33 . . . . 0.0 107.269 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -63.09 -39.72 95.55 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 126.465 1.906 . . . . 0.0 115.55 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.9 mp -64.59 -53.98 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 177.504 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -63.55 -31.65 72.87 Favored 'General case' 0 CA--C 1.571 1.78 0 CA-C-O 117.902 -1.046 . . . . 0.0 110.881 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt . . . . . 0 CA--C 1.57 1.738 0 CA-C-N 120.363 1.438 . . . . 0.0 113.315 177.14 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt . . . . . 0 CA--C 1.582 2.185 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.317 3.0 pp -81.73 -60.12 2.36 Favored 'General case' 0 CA--C 1.559 1.323 0 C-N-CA 125.675 1.59 . . . . 0.0 108.187 177.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.05 -42.29 14.98 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 125.599 1.56 . . . . 0.0 108.656 176.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -59.15 -38.34 79.46 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 116.591 -1.671 . . . . 0.0 112.537 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -65.37 -47.17 77.32 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 121.404 1.911 . . . . 0.0 110.207 176.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.317 0.5 OUTLIER -63.16 -17.24 19.21 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.45 0 C-N-CA 125.337 1.455 . . . . 0.0 113.983 177.301 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -92.47 -36.43 13.09 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 127.445 2.298 . . . . 0.0 107.614 176.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -65.09 -43.84 90.81 Favored 'General case' 0 CA--C 1.563 1.459 0 C-N-CA 126.433 1.893 . . . . 0.0 114.395 177.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -64.63 -50.84 73.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -62.2 -33.46 74.59 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.779 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt . . . . . 0 CA--C 1.571 1.762 0 CA-C-N 119.921 1.237 . . . . 0.0 113.475 177.245 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.5 mtt . . . . . 0 CA--C 1.575 1.924 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 76.3 mt -82.75 -77.42 0.24 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.543 1.937 . . . . 0.0 105.935 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 tttp -72.6 -33.63 66.82 Favored 'General case' 0 CA--C 1.565 1.541 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.862 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.66 -40.4 92.39 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 116.517 -1.706 . . . . 0.0 111.279 177.203 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -63.87 -45.68 88.32 Favored 'General case' 0 N--CA 1.501 2.102 0 CA-C-N 121.623 2.01 . . . . 0.0 110.855 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -63.3 -18.94 22.78 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.433 0 C-N-CA 125.157 1.383 . . . . 0.0 113.741 177.306 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -88.89 -39.69 13.62 Favored 'General case' 0 CA--C 1.572 1.821 0 C-N-CA 126.983 2.113 . . . . 0.0 107.211 176.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -65.55 -44.27 87.32 Favored 'General case' 0 CA--C 1.563 1.465 0 C-N-CA 126.355 1.862 . . . . 0.0 114.828 177.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.7 mp -65.88 -52.15 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -60.79 -31.69 71.06 Favored 'General case' 0 CA--C 1.571 1.783 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.248 176.413 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 CA--C 1.567 1.6 0 CA-C-N 119.638 1.108 . . . . 0.0 111.995 177.168 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 32.9 mtm . . . . . 0 CA--C 1.583 2.236 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.311 2.9 pp -81.89 -61.17 1.99 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 125.847 1.659 . . . . 0.0 108.109 177.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -84.5 -38.6 19.89 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 125.609 1.564 . . . . 0.0 109.822 176.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.09 -38.58 91.74 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 116.726 -1.606 . . . . 0.0 111.763 177.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -65.28 -46.29 81.06 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 121.36 1.891 . . . . 0.0 110.341 176.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.32 0.5 OUTLIER -63.27 -18.72 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.403 0 C-N-CA 125.161 1.384 . . . . 0.0 113.804 177.278 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -89.48 -37.91 14.42 Favored 'General case' 0 CA--C 1.572 1.818 0 C-N-CA 127.116 2.166 . . . . 0.0 107.426 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -66.06 -44.67 83.88 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 126.457 1.903 . . . . 0.0 114.546 177.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -66.07 -52.0 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 107.07 -1.455 . . . . 0.0 107.07 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -60.58 -30.57 69.89 Favored 'General case' 0 CA--C 1.572 1.805 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.329 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt . . . . . 0 CA--C 1.567 1.618 0 CA-C-N 119.768 1.167 . . . . 0.0 111.609 177.136 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.9 mtt . . . . . 0 CA--C 1.575 1.927 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.8 mt -83.82 -75.52 0.33 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.938 2.095 . . . . 0.0 105.671 177.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -72.55 -33.76 67.05 Favored 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.121 176.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -66.87 -39.01 87.39 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-O 116.34 -1.79 . . . . 0.0 111.16 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -63.69 -46.35 85.93 Favored 'General case' 0 N--CA 1.501 2.107 0 CA-C-N 121.857 2.117 . . . . 0.0 110.561 176.494 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.321 0.5 OUTLIER -63.45 -15.91 17.13 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.438 0 C-N-CA 125.286 1.434 . . . . 0.0 114.349 177.376 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -92.98 -40.95 10.27 Favored 'General case' 0 CA--C 1.571 1.783 0 C-N-CA 127.452 2.301 . . . . 0.0 106.717 176.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -62.28 -41.83 98.82 Favored 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 126.453 1.901 . . . . 0.0 115.004 177.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.277 1.8 mp -65.78 -51.89 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.236 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -60.56 -31.72 70.82 Favored 'General case' 0 CA--C 1.572 1.804 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.414 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.9 tmmm? . . . . . 0 CA--C 1.568 1.635 0 CA-C-N 119.305 0.957 . . . . 0.0 111.524 177.307 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.7 mtt . . . . . 0 CA--C 1.577 1.984 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.6 mt -86.24 -74.71 0.41 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.13 2.172 . . . . 0.0 106.103 177.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -69.6 -34.77 74.57 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.846 176.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.26 -39.56 89.54 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-O 116.309 -1.805 . . . . 0.0 110.654 177.007 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -62.78 -46.98 85.47 Favored 'General case' 0 N--CA 1.501 2.079 0 CA-C-N 121.764 2.075 . . . . 0.0 110.525 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.61 -14.23 14.36 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.405 0 C-N-CA 125.304 1.442 . . . . 0.0 114.659 177.427 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -95.21 -38.36 10.61 Favored 'General case' 0 CA--C 1.575 1.927 0 C-N-CA 127.609 2.364 . . . . 0.0 107.029 176.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -63.19 -40.74 98.36 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 126.629 1.972 . . . . 0.0 115.422 177.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.8 mp -65.32 -54.32 30.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 177.547 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -62.54 -28.38 69.82 Favored 'General case' 0 CA--C 1.574 1.886 0 CA-C-O 117.813 -1.089 . . . . 0.0 111.459 176.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt . . . . . 0 CA--C 1.568 1.64 0 CA-C-N 119.922 1.237 . . . . 0.0 112.023 177.175 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt . . . . . 0 CA--C 1.583 2.218 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.321 3.2 pp -82.48 -60.16 2.29 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 125.536 1.534 . . . . 0.0 107.9 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.65 -37.75 20.65 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 125.552 1.541 . . . . 0.0 109.853 176.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.63 -39.15 93.64 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 116.925 -1.512 . . . . 0.0 111.62 177.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -64.59 -46.37 82.99 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 121.164 1.802 . . . . 0.0 110.644 176.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -63.35 -19.37 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.457 0 C-N-CA 125.149 1.38 . . . . 0.0 113.569 177.261 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -88.96 -36.59 15.79 Favored 'General case' 0 CA--C 1.573 1.858 0 C-N-CA 127.094 2.158 . . . . 0.0 107.678 176.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -66.11 -45.21 81.94 Favored 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 126.488 1.915 . . . . 0.0 114.338 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.281 1.9 mp -66.96 -51.49 54.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 177.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -60.26 -29.88 69.07 Favored 'General case' 0 CA--C 1.572 1.824 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.117 176.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 CA--C 1.567 1.622 0 CA-C-N 119.515 1.052 . . . . 0.0 110.526 177.049 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.9 mtt . . . . . 0 CA--C 1.573 1.865 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.6 mt -86.31 -74.6 0.41 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.464 1.906 . . . . 0.0 106.147 177.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -70.6 -34.05 71.73 Favored 'General case' 0 CA--C 1.563 1.451 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.959 176.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.92 -39.45 87.38 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 116.449 -1.739 . . . . 0.0 110.792 177.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -63.17 -46.75 85.7 Favored 'General case' 0 N--CA 1.501 2.1 0 CA-C-N 121.753 2.07 . . . . 0.0 110.698 176.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.02 -17.57 19.69 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.374 0 C-N-CA 125.26 1.424 . . . . 0.0 114.084 177.35 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -91.36 -39.12 12.2 Favored 'General case' 0 CA--C 1.57 1.738 0 C-N-CA 127.16 2.184 . . . . 0.0 107.182 176.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -62.02 -44.46 96.68 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 126.597 1.959 . . . . 0.0 115.311 177.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -64.32 -51.33 69.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 177.305 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -61.95 -33.4 74.22 Favored 'General case' 0 CA--C 1.57 1.733 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.973 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt . . . . . 0 CA--C 1.568 1.656 0 CA-C-N 119.946 1.248 . . . . 0.0 113.646 177.372 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.2 ptp . . . . . 0 CA--C 1.581 2.158 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.319 3.0 pp -82.45 -61.39 1.9 Allowed 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 125.811 1.644 . . . . 0.0 107.471 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.4 tttp -84.79 -37.62 20.57 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 125.49 1.516 . . . . 0.0 109.537 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.96 -38.84 92.72 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 116.583 -1.675 . . . . 0.0 111.519 177.22 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -64.12 -46.81 82.52 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 121.423 1.919 . . . . 0.0 110.093 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.318 0.5 OUTLIER -64.36 -11.89 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.481 0 C-N-CA 125.319 1.448 . . . . 0.0 114.6 177.285 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -98.34 -37.32 9.68 Favored 'General case' 0 CA--C 1.575 1.906 0 C-N-CA 127.913 2.485 . . . . 0.0 107.26 176.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -64.57 -41.25 96.41 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 126.577 1.951 . . . . 0.0 115.645 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.277 1.8 mp -64.68 -52.16 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 124.383 1.073 . . . . 0.0 108.105 177.539 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -64.05 -32.81 74.49 Favored 'General case' 0 CA--C 1.571 1.774 0 CA-C-O 117.792 -1.099 . . . . 0.0 110.67 176.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt . . . . . 0 CA--C 1.567 1.61 0 CA-C-N 120.057 1.299 . . . . 0.0 114.179 177.356 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.3 mtp . . . . . 0 CA--C 1.571 1.775 0 N-CA-C 116.875 2.176 . . . . 0.0 116.875 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.1 mt -79.55 -78.26 0.16 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.844 2.057 . . . . 0.0 108.629 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -72.37 -33.24 67.1 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-O 117.707 -1.139 . . . . 0.0 112.588 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . 0.262 0.2 OUTLIER -67.42 -41.22 85.2 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 116.93 -1.51 . . . . 0.0 111.306 177.386 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -62.23 -46.31 89.42 Favored 'General case' 0 N--CA 1.501 2.117 0 CA-C-N 120.639 1.563 . . . . 0.0 111.267 176.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.325 0.5 OUTLIER -62.7 -21.44 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.323 0 C-N-CA 125.149 1.38 . . . . 0.0 113.665 177.325 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -87.14 -37.5 17.29 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 126.618 1.967 . . . . 0.0 107.54 176.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -64.07 -44.86 91.12 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 126.467 1.907 . . . . 0.0 114.638 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.272 1.8 mp -65.71 -52.47 49.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.328 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -61.15 -28.28 69.0 Favored 'General case' 0 CA--C 1.572 1.815 0 CA-C-O 118.006 -0.997 . . . . 0.0 111.789 176.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt . . . . . 0 CA--C 1.567 1.62 0 CA-C-N 119.929 1.241 . . . . 0.0 111.762 177.193 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 18.8 ptt? . . . . . 0 CA--C 1.583 2.24 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.32 3.1 pp -83.16 -61.45 1.85 Allowed 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 125.827 1.651 . . . . 0.0 107.468 177.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -82.98 -37.25 24.29 Favored 'General case' 0 CA--C 1.561 1.402 0 C-N-CA 125.225 1.41 . . . . 0.0 109.641 176.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -63.01 -39.24 94.17 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 116.743 -1.598 . . . . 0.0 111.262 177.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -63.93 -46.76 83.3 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 121.23 1.832 . . . . 0.0 109.981 176.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.317 0.5 OUTLIER -65.26 -9.66 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.482 0 C-N-CA 125.323 1.449 . . . . 0.0 114.748 177.285 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -99.73 -37.37 9.13 Favored 'General case' 0 CA--C 1.577 1.99 0 C-N-CA 128.272 2.629 . . . . 0.0 107.066 176.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -65.5 -41.29 93.4 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 126.632 1.973 . . . . 0.0 115.278 177.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.276 1.8 mp -64.95 -53.52 40.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -61.98 -31.27 71.62 Favored 'General case' 0 CA--C 1.572 1.8 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.897 176.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt . . . . . 0 CA--C 1.567 1.628 0 CA-C-N 119.875 1.216 . . . . 0.0 111.664 177.135 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.8 mtt . . . . . 0 CA--C 1.576 1.955 0 N-CA-C 115.894 1.813 . . . . 0.0 115.894 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 74.4 mt -80.59 -76.96 0.21 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.758 2.023 . . . . 0.0 105.666 177.704 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -75.58 -33.59 60.6 Favored 'General case' 0 CA--C 1.564 1.512 0 CA-C-O 117.806 -1.092 . . . . 0.0 110.789 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.29 -39.7 92.89 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 116.455 -1.736 . . . . 0.0 111.701 177.264 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -64.22 -45.96 85.94 Favored 'General case' 0 N--CA 1.501 2.101 0 CA-C-N 121.679 2.036 . . . . 0.0 110.669 176.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.48 -17.39 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.443 0 C-N-CA 125.279 1.432 . . . . 0.0 114.01 177.361 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -90.91 -40.09 11.91 Favored 'General case' 0 CA--C 1.57 1.722 0 C-N-CA 127.283 2.233 . . . . 0.0 107.069 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -63.2 -43.94 96.74 Favored 'General case' 0 CA--C 1.561 1.403 0 C-N-CA 126.414 1.886 . . . . 0.0 115.086 177.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.281 1.8 mp -65.93 -52.57 47.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 177.446 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -60.6 -30.19 69.67 Favored 'General case' 0 CA--C 1.572 1.806 0 CA-C-O 118.44 -0.79 . . . . 0.0 111.693 176.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt . . . . . 0 CA--C 1.565 1.521 0 CA-C-N 119.37 0.987 . . . . 0.0 111.46 177.262 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 33.1 mtm . . . . . 0 CA--C 1.574 1.872 0 N-CA-C 115.864 1.802 . . . . 0.0 115.864 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 84.3 mt -89.76 -69.81 0.7 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.361 2.264 . . . . 0.0 105.353 177.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -67.68 -35.51 78.97 Favored 'General case' 0 CA--C 1.563 1.469 0 C-N-CA 124.014 0.926 . . . . 0.0 111.661 176.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.74 -39.9 80.13 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 116.501 -1.714 . . . . 0.0 109.967 176.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -62.1 -46.79 87.51 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-N 121.542 1.974 . . . . 0.0 110.962 176.562 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.324 0.5 OUTLIER -62.48 -21.64 27.67 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.381 0 C-N-CA 125.174 1.39 . . . . 0.0 113.687 177.35 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -86.48 -37.84 17.88 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 126.692 1.997 . . . . 0.0 107.623 176.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -64.95 -44.77 88.32 Favored 'General case' 0 CA--C 1.562 1.416 0 C-N-CA 126.418 1.887 . . . . 0.0 114.701 177.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.8 mp -66.17 -52.2 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 177.394 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -60.87 -30.06 69.92 Favored 'General case' 0 CA--C 1.572 1.821 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.391 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt . . . . . 0 CA--C 1.565 1.548 0 CA-C-N 119.725 1.148 . . . . 0.0 110.881 177.131 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.5 mtt . . . . . 0 CA--C 1.575 1.91 0 N-CA-C 116.094 1.886 . . . . 0.0 116.094 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 81.2 mt -83.9 -75.22 0.34 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.76 2.024 . . . . 0.0 105.717 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -72.53 -33.93 67.2 Favored 'General case' 0 CA--C 1.561 1.391 0 CA-C-O 117.955 -1.022 . . . . 0.0 111.07 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -66.73 -39.21 87.89 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 116.502 -1.713 . . . . 0.0 111.216 177.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -63.79 -46.3 85.81 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 121.695 2.043 . . . . 0.0 110.799 176.567 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -62.75 -20.22 24.82 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.369 0 C-N-CA 125.154 1.382 . . . . 0.0 113.746 177.292 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -87.82 -38.87 15.33 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 126.937 2.095 . . . . 0.0 107.347 176.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -64.54 -44.87 89.46 Favored 'General case' 0 CA--C 1.561 1.378 0 C-N-CA 126.351 1.86 . . . . 0.0 114.992 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.8 mp -65.69 -52.19 53.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.412 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -60.76 -31.72 71.05 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.367 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm . . . . . 0 CA--C 1.564 1.516 0 CA-C-N 119.737 1.153 . . . . 0.0 111.877 177.245 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.3 mtp . . . . . 0 CA--C 1.575 1.908 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 73.9 mt -81.17 -78.09 0.19 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.673 1.989 . . . . 0.0 106.306 177.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -72.93 -33.78 66.15 Favored 'General case' 0 CA--C 1.563 1.466 0 CA-C-O 117.769 -1.11 . . . . 0.0 110.894 176.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -64.69 -40.66 95.76 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 116.636 -1.65 . . . . 0.0 111.448 177.158 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -63.86 -46.3 85.61 Favored 'General case' 0 N--CA 1.501 2.121 0 CA-C-N 121.428 1.922 . . . . 0.0 110.785 176.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -62.83 -19.94 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.395 0 C-N-CA 125.255 1.422 . . . . 0.0 113.812 177.298 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -88.14 -37.12 16.44 Favored 'General case' 0 CA--C 1.573 1.839 0 C-N-CA 126.91 2.084 . . . . 0.0 107.508 176.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -65.6 -44.87 85.28 Favored 'General case' 0 CA--C 1.563 1.477 0 C-N-CA 126.428 1.891 . . . . 0.0 114.387 177.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -66.1 -51.71 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -60.22 -31.89 70.6 Favored 'General case' 0 CA--C 1.57 1.749 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.123 176.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 CA--C 1.567 1.62 0 CA-C-N 119.799 1.182 . . . . 0.0 111.762 177.179 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 30.4 mtp . . . . . 0 CA--C 1.583 2.22 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.312 2.8 pp -80.75 -61.51 1.95 Allowed 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 125.935 1.694 . . . . 0.0 107.906 177.956 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -86.67 -37.5 17.94 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.578 1.551 . . . . 0.0 109.5 176.925 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -63.0 -38.58 91.77 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-O 116.782 -1.58 . . . . 0.0 111.973 177.313 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -65.75 -46.15 79.94 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 121.339 1.881 . . . . 0.0 110.328 176.594 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.319 0.5 OUTLIER -64.06 -16.35 18.68 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.424 0 C-N-CA 125.201 1.4 . . . . 0.0 113.757 177.193 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -91.27 -39.11 12.26 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 127.452 2.301 . . . . 0.0 107.24 176.766 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -65.01 -47.91 75.8 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 126.406 1.882 . . . . 0.0 115.187 177.636 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.267 1.8 mp -65.93 -51.3 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 177.534 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -60.14 -32.64 71.21 Favored 'General case' 0 CA--C 1.567 1.634 0 CA-C-O 117.612 -1.185 . . . . 0.0 111.252 176.512 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm . . . . . 0 CA--C 1.567 1.607 0 CA-C-N 120.152 1.342 . . . . 0.0 111.679 177.214 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 103.399 -2.815 . . . . 0.0 103.399 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -146.56 65.32 1.19 Allowed 'General case' 0 CA--C 1.562 1.44 0 CA-C-O 122.934 1.35 . . . . 0.0 111.778 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -152.1 -52.44 0.12 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 125.803 1.641 . . . . 0.0 107.815 177.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt -77.86 28.21 0.17 Allowed 'General case' 0 CA--C 1.583 2.223 0 CA-C-N 119.531 1.06 . . . . 0.0 112.455 176.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.315 2.9 pp -81.31 -61.2 2.01 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 126.011 1.724 . . . . 0.0 107.917 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -85.28 -40.75 16.23 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 125.684 1.593 . . . . 0.0 108.865 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -59.99 -38.57 82.99 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 116.643 -1.646 . . . . 0.0 112.277 177.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -65.18 -47.34 77.31 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 121.375 1.898 . . . . 0.0 110.19 176.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.315 0.5 OUTLIER -63.18 -17.34 19.42 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.463 0 C-N-CA 125.304 1.442 . . . . 0.0 113.967 177.355 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -92.16 -37.27 12.82 Favored 'General case' 0 CA--C 1.571 1.775 0 C-N-CA 127.365 2.266 . . . . 0.0 107.364 176.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -64.1 -43.49 95.22 Favored 'General case' 0 CA--C 1.562 1.424 0 C-N-CA 126.462 1.905 . . . . 0.0 114.616 177.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -64.65 -51.1 71.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.262 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -62.1 -33.11 73.84 Favored 'General case' 0 CA--C 1.571 1.759 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.928 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -68.1 -34.42 76.37 Favored 'General case' 0 CA--C 1.569 1.711 0 CA-C-N 119.755 1.161 . . . . 0.0 113.568 177.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -61.62 -51.56 68.0 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 115.198 1.555 . . . . 0.0 115.198 177.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -79.67 -43.55 22.56 Favored 'General case' 0 CA--C 1.56 1.356 0 N-CA-C 116.698 2.11 . . . . 0.0 116.698 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -85.23 -35.96 21.25 Favored 'General case' 0 CA--C 1.564 1.496 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.0 mt 58.75 60.91 2.34 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 114.911 1.449 . . . . 0.0 114.911 177.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -87.24 56.15 3.85 Favored 'General case' 0 CA--C 1.57 1.741 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm . . . . . 0 N--CA 1.483 1.188 0 O-C-N 120.951 -1.093 . . . . 0.0 110.887 -179.936 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.243 0 N-CA-C 103.747 -2.686 . . . . 0.0 103.747 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -142.66 60.63 1.43 Allowed 'General case' 0 CA--C 1.557 1.229 0 CA-C-O 122.827 1.299 . . . . 0.0 111.358 -179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -143.44 -60.84 0.41 Allowed 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 177.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.7 mtt -73.16 19.3 0.09 Allowed 'General case' 0 CA--C 1.575 1.916 0 N-CA-C 115.767 1.765 . . . . 0.0 115.767 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 76.8 mt -83.01 -77.25 0.25 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.494 1.918 . . . . 0.0 105.972 177.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -72.64 -34.07 67.03 Favored 'General case' 0 CA--C 1.565 1.523 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.836 176.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -65.66 -39.71 91.65 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-O 116.315 -1.802 . . . . 0.0 111.46 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.0 t30 -63.88 -45.26 90.21 Favored 'General case' 0 N--CA 1.501 2.123 0 CA-C-N 121.873 2.124 . . . . 0.0 110.6 176.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.321 0.5 OUTLIER -65.47 -10.43 10.05 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.501 0 C-N-CA 125.354 1.462 . . . . 0.0 114.587 177.306 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -99.3 -39.05 8.61 Favored 'General case' 0 CA--C 1.573 1.861 0 C-N-CA 128.108 2.563 . . . . 0.0 107.193 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -64.78 -44.84 88.71 Favored 'General case' 0 CA--C 1.561 1.371 0 C-N-CA 126.54 1.936 . . . . 0.0 115.123 177.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -65.5 -51.29 65.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 177.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.4 mm-40 -61.29 -31.16 70.99 Favored 'General case' 0 CA--C 1.57 1.742 0 CA-C-O 118.339 -0.838 . . . . 0.0 111.289 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -68.33 -50.74 51.29 Favored 'General case' 0 CA--C 1.565 1.555 0 CA-C-N 119.454 1.025 . . . . 0.0 111.337 177.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -53.25 -53.34 52.26 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 114.911 1.449 . . . . 0.0 114.911 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.266 39.3 tp60 -57.42 -44.93 85.03 Favored 'General case' 0 CA--C 1.562 1.42 0 C-N-CA 126.841 2.056 . . . . 0.0 115.622 177.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -62.54 -37.19 85.15 Favored 'General case' 0 CA--C 1.565 1.536 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 177.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.7 mt -64.15 -22.14 66.82 Favored 'General case' 0 CA--C 1.563 1.442 0 N-CA-C 118.095 2.628 . . . . 0.0 118.095 177.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -77.76 76.92 4.28 Favored 'General case' 0 CA--C 1.573 1.86 0 C-N-CA 124.582 1.153 . . . . 0.0 112.864 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.6 tptm . . . . . 0 N--CA 1.485 1.291 0 O-C-N 120.769 -1.207 . . . . 0.0 110.757 -179.973 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 102.386 -3.19 . . . . 0.0 102.386 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.3 ptt? -149.11 65.82 1.03 Allowed 'General case' 0 CA--C 1.563 1.447 0 CA-C-O 122.615 1.198 . . . . 0.0 111.922 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -152.47 -53.42 0.12 Allowed 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 125.4 1.48 . . . . 0.0 107.893 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 18.8 ptt? -79.94 31.43 0.26 Allowed 'General case' 0 CA--C 1.583 2.23 0 CA-C-N 119.737 1.153 . . . . 0.0 111.836 176.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.31 2.9 pp -82.41 -60.95 2.03 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 125.811 1.644 . . . . 0.0 107.795 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -84.64 -38.79 19.41 Favored 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 125.712 1.605 . . . . 0.0 109.665 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.11 -38.43 91.16 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 116.469 -1.729 . . . . 0.0 111.658 177.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -64.53 -45.93 85.06 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-N 121.608 2.004 . . . . 0.0 109.945 176.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -65.92 -7.74 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.545 0 C-N-CA 125.329 1.451 . . . . 0.0 114.799 177.319 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -102.85 -36.9 8.07 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 128.397 2.679 . . . . 0.0 107.193 176.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -65.5 -41.17 93.51 Favored 'General case' 0 CA--C 1.56 1.356 0 C-N-CA 126.546 1.938 . . . . 0.0 115.545 177.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.28 1.8 mp -64.79 -53.55 40.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -62.24 -30.88 71.41 Favored 'General case' 0 CA--C 1.572 1.794 0 CA-C-O 117.99 -1.005 . . . . 0.0 111.129 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -69.18 -46.62 67.06 Favored 'General case' 0 CA--C 1.569 1.685 0 CA-C-N 119.905 1.229 . . . . 0.0 112.258 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -50.61 -56.98 9.33 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 177.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -67.97 -31.45 71.18 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 116.27 1.952 . . . . 0.0 116.27 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.6 t30 -66.98 -37.29 83.97 Favored 'General case' 0 CA--C 1.563 1.455 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 177.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 mt -60.22 -61.49 2.57 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 124.553 1.141 . . . . 0.0 112.642 177.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 31.6 p90 -99.93 58.5 1.02 Allowed 'General case' 0 CA--C 1.57 1.727 0 C-N-CA 125.414 1.486 . . . . 0.0 110.692 177.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 44.8 tptt . . . . . 0 N--CA 1.483 1.185 0 O-C-N 120.954 -1.091 . . . . 0.0 111.947 -179.69 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 103.162 -2.903 . . . . 0.0 103.162 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -144.47 60.71 1.34 Allowed 'General case' 0 CA--C 1.557 1.236 0 CA-C-O 122.683 1.23 . . . . 0.0 111.372 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -143.76 -59.77 0.4 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 177.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.6 mtt -72.68 17.47 0.11 Allowed 'General case' 0 CA--C 1.575 1.921 0 N-CA-C 115.839 1.792 . . . . 0.0 115.839 177.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 81.7 mt -84.13 -75.37 0.34 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.779 2.032 . . . . 0.0 105.961 177.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -71.73 -34.67 69.74 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 118.082 -0.961 . . . . 0.0 111.01 176.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.18 -39.52 89.77 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 116.341 -1.79 . . . . 0.0 111.13 177.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -63.63 -45.88 88.24 Favored 'General case' 0 N--CA 1.501 2.105 0 CA-C-N 121.842 2.11 . . . . 0.0 110.642 176.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -64.6 -12.92 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 C-N-CA 125.251 1.42 . . . . 0.0 114.469 177.316 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -96.3 -39.49 9.61 Favored 'General case' 0 CA--C 1.573 1.828 0 C-N-CA 127.71 2.404 . . . . 0.0 107.028 176.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -64.23 -44.21 92.58 Favored 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 126.598 1.959 . . . . 0.0 115.072 177.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.8 mp -64.37 -51.42 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 177.389 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.2 mm-40 -62.32 -32.97 73.8 Favored 'General case' 0 CA--C 1.57 1.733 0 CA-C-O 118.289 -0.862 . . . . 0.0 110.911 176.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -67.41 -37.93 83.84 Favored 'General case' 0 CA--C 1.571 1.752 0 CA-C-N 119.818 1.19 . . . . 0.0 113.182 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -62.12 -53.18 59.08 Favored 'General case' 0 CA--C 1.559 1.316 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 177.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -77.61 -43.3 32.01 Favored 'General case' 0 CA--C 1.559 1.324 0 N-CA-C 117.268 2.321 . . . . 0.0 117.268 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -87.52 -33.75 18.85 Favored 'General case' 0 CA--C 1.559 1.307 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mt 56.42 71.06 0.59 Allowed 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 119.756 1.162 . . . . 0.0 113.626 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -76.92 79.03 3.49 Favored 'General case' 0 CA--C 1.574 1.88 0 C-N-CA 123.895 0.878 . . . . 0.0 113.062 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.4 tttp . . . . . 0 N--CA 1.487 1.395 0 O-C-N 120.836 -1.165 . . . . 0.0 112.268 -179.974 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.2 mmt -138.82 59.99 1.61 Allowed 'General case' 0 CA--C 1.563 1.45 0 C-N-CA 125.195 1.398 . . . . 0.0 111.282 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 -137.18 -53.82 0.69 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 125.74 1.616 . . . . 0.0 107.827 177.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.1 mtt -75.84 26.81 0.11 Allowed 'General case' 0 CA--C 1.58 2.131 0 CA-C-N 119.511 1.05 . . . . 0.0 113.283 177.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.321 3.0 pp -81.03 -60.61 2.23 Favored 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 125.531 1.532 . . . . 0.0 107.684 177.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -87.27 -37.77 16.9 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 125.591 1.556 . . . . 0.0 109.435 176.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -62.64 -38.52 90.58 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 116.508 -1.711 . . . . 0.0 111.729 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -64.61 -46.52 82.3 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 121.552 1.978 . . . . 0.0 109.977 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.319 0.5 OUTLIER -65.13 -9.99 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 C-N-CA 125.311 1.444 . . . . 0.0 114.707 177.269 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -100.24 -37.05 9.07 Favored 'General case' 0 CA--C 1.575 1.94 0 C-N-CA 128.223 2.609 . . . . 0.0 107.195 176.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -65.01 -40.97 95.69 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 126.544 1.938 . . . . 0.0 115.558 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.276 1.9 mp -65.35 -53.86 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 177.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -62.23 -29.0 70.08 Favored 'General case' 0 CA--C 1.572 1.81 0 CA-C-O 117.69 -1.148 . . . . 0.0 111.344 176.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.7 ttpt -71.34 -45.67 62.4 Favored 'General case' 0 CA--C 1.57 1.73 0 CA-C-N 120.097 1.317 . . . . 0.0 112.101 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.0 t30 -50.54 -54.1 25.09 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 177.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -79.78 -27.04 40.45 Favored 'General case' 0 CA--C 1.568 1.639 0 N-CA-C 116.248 1.944 . . . . 0.0 116.248 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -149.88 82.54 1.39 Allowed 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.3 mt -43.88 -40.43 4.54 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 177.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -59.73 -50.38 74.05 Favored 'General case' 0 CA--C 1.565 1.534 0 C-N-CA 125.694 1.598 . . . . 0.0 114.329 177.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.555 1.145 0 C-N-CA 124.917 1.287 . . . . 0.0 107.951 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.482 1.143 0 N-CA-C 102.733 -3.062 . . . . 0.0 102.733 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.77 55.89 1.49 Allowed 'General case' 0 CA--C 1.558 1.274 0 CA-C-O 122.488 1.137 . . . . 0.0 112.938 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -141.94 -61.19 0.46 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 177.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.7 mtt -72.12 19.0 0.08 Allowed 'General case' 0 CA--C 1.574 1.894 0 N-CA-C 115.956 1.835 . . . . 0.0 115.956 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 73.1 mt -81.78 -77.02 0.23 Allowed 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 177.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -74.42 -33.78 63.07 Favored 'General case' 0 CA--C 1.565 1.537 0 CA-C-O 118.077 -0.963 . . . . 0.0 110.84 176.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.68 -39.7 91.58 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 116.287 -1.816 . . . . 0.0 111.399 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -63.31 -46.61 85.9 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-N 121.891 2.132 . . . . 0.0 110.43 176.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.62 -14.2 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.383 0 C-N-CA 125.301 1.44 . . . . 0.0 114.52 177.433 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -96.56 -36.56 10.71 Favored 'General case' 0 CA--C 1.573 1.853 0 C-N-CA 127.525 2.33 . . . . 0.0 107.269 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -63.09 -39.72 95.55 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 126.465 1.906 . . . . 0.0 115.55 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.9 mp -64.59 -53.98 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 177.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -63.55 -31.65 72.87 Favored 'General case' 0 CA--C 1.571 1.78 0 CA-C-O 117.902 -1.046 . . . . 0.0 110.881 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -68.36 -34.52 76.22 Favored 'General case' 0 CA--C 1.57 1.738 0 CA-C-N 120.363 1.438 . . . . 0.0 113.315 177.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -61.68 -51.58 67.83 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 177.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -80.02 -42.45 23.79 Favored 'General case' 0 CA--C 1.56 1.364 0 N-CA-C 116.903 2.186 . . . . 0.0 116.903 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -85.0 -35.14 22.15 Favored 'General case' 0 CA--C 1.561 1.366 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.2 mt 56.64 53.45 8.42 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 115.858 1.799 . . . . 0.0 115.858 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -82.19 -178.38 7.0 Favored 'General case' 0 CA--C 1.572 1.81 0 C-N-CA 125.079 1.352 . . . . 0.0 113.168 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? . . . . . 0 CA--C 1.56 1.338 0 O-C-N 121.019 -1.051 . . . . 0.0 111.877 179.987 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 102.835 -3.024 . . . . 0.0 102.835 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -142.41 55.53 1.44 Allowed 'General case' 0 CA--C 1.565 1.521 0 CA-C-O 122.364 1.078 . . . . 0.0 113.554 -179.208 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -141.75 -52.6 0.43 Allowed 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.765 1.626 . . . . 0.0 107.536 177.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt -76.95 29.26 0.13 Allowed 'General case' 0 CA--C 1.582 2.185 0 CA-C-N 119.726 1.148 . . . . 0.0 112.644 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.317 3.0 pp -81.73 -60.12 2.36 Favored 'General case' 0 CA--C 1.559 1.323 0 C-N-CA 125.675 1.59 . . . . 0.0 108.187 177.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.05 -42.29 14.98 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 125.599 1.56 . . . . 0.0 108.656 176.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -59.15 -38.34 79.46 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 116.591 -1.671 . . . . 0.0 112.537 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -65.37 -47.17 77.32 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 121.404 1.911 . . . . 0.0 110.207 176.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.317 0.5 OUTLIER -63.16 -17.24 19.21 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.45 0 C-N-CA 125.337 1.455 . . . . 0.0 113.983 177.301 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -92.47 -36.43 13.09 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 127.445 2.298 . . . . 0.0 107.614 176.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -65.09 -43.84 90.81 Favored 'General case' 0 CA--C 1.563 1.459 0 C-N-CA 126.433 1.893 . . . . 0.0 114.395 177.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -64.63 -50.84 73.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -62.2 -33.46 74.59 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.779 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -67.02 -34.49 77.84 Favored 'General case' 0 CA--C 1.571 1.762 0 CA-C-N 119.921 1.237 . . . . 0.0 113.475 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -61.89 -51.58 67.61 Favored 'General case' 0 CA--C 1.561 1.378 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -79.33 -43.35 23.72 Favored 'General case' 0 CA--C 1.562 1.408 0 N-CA-C 116.842 2.164 . . . . 0.0 116.842 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -86.24 -32.75 20.98 Favored 'General case' 0 CA--C 1.561 1.383 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.253 4.3 mt 56.89 53.05 8.56 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 116.106 1.891 . . . . 0.0 116.106 177.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -84.03 -179.19 7.19 Favored 'General case' 0 CA--C 1.573 1.834 0 C-N-CA 125.052 1.341 . . . . 0.0 112.934 177.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? . . . . . 0 CA--C 1.56 1.353 0 O-C-N 121.001 -1.062 . . . . 0.0 112.299 179.682 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 102.764 -3.051 . . . . 0.0 102.764 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -144.76 60.26 1.32 Allowed 'General case' 0 CA--C 1.556 1.193 0 CA-C-O 122.644 1.211 . . . . 0.0 111.694 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -144.7 -60.82 0.37 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 177.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.5 mtt -73.08 19.46 0.09 Allowed 'General case' 0 CA--C 1.575 1.924 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 177.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 76.3 mt -82.75 -77.42 0.24 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.543 1.937 . . . . 0.0 105.935 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 tttp -72.6 -33.63 66.82 Favored 'General case' 0 CA--C 1.565 1.541 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.862 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.66 -40.4 92.39 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 116.517 -1.706 . . . . 0.0 111.279 177.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -63.87 -45.68 88.32 Favored 'General case' 0 N--CA 1.501 2.102 0 CA-C-N 121.623 2.01 . . . . 0.0 110.855 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -63.3 -18.94 22.78 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.433 0 C-N-CA 125.157 1.383 . . . . 0.0 113.741 177.306 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -88.89 -39.69 13.62 Favored 'General case' 0 CA--C 1.572 1.821 0 C-N-CA 126.983 2.113 . . . . 0.0 107.211 176.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -65.55 -44.27 87.32 Favored 'General case' 0 CA--C 1.563 1.465 0 C-N-CA 126.355 1.862 . . . . 0.0 114.828 177.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.7 mp -65.88 -52.15 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -60.79 -31.69 71.06 Favored 'General case' 0 CA--C 1.571 1.783 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.248 176.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -69.66 -49.07 57.21 Favored 'General case' 0 CA--C 1.567 1.6 0 CA-C-N 119.638 1.108 . . . . 0.0 111.995 177.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -50.25 -57.46 7.76 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 177.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.252 6.9 pt20 -65.92 -32.28 73.69 Favored 'General case' 0 CA--C 1.561 1.395 0 N-CA-C 116.797 2.147 . . . . 0.0 116.797 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.3 t30 -68.73 -36.91 79.0 Favored 'General case' 0 CA--C 1.563 1.477 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 177.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.1 mt -60.84 -61.83 2.3 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.637 1.175 . . . . 0.0 113.728 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -83.59 -176.93 6.54 Favored 'General case' 0 CA--C 1.572 1.819 0 C-N-CA 124.63 1.172 . . . . 0.0 112.764 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 85.1 tttt . . . . . 0 CA--C 1.557 1.213 0 O-C-N 121.053 -1.029 . . . . 0.0 111.023 179.975 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 103.097 -2.927 . . . . 0.0 103.097 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -147.46 65.05 1.14 Allowed 'General case' 0 CA--C 1.562 1.421 0 CA-C-O 122.774 1.273 . . . . 0.0 111.812 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -153.02 -54.36 0.11 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.72 1.608 . . . . 0.0 107.264 177.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 32.9 mtm -77.65 30.1 0.16 Allowed 'General case' 0 CA--C 1.583 2.236 0 CA-C-N 119.627 1.103 . . . . 0.0 112.142 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.311 2.9 pp -81.89 -61.17 1.99 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 125.847 1.659 . . . . 0.0 108.109 177.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -84.5 -38.6 19.89 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 125.609 1.564 . . . . 0.0 109.822 176.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.09 -38.58 91.74 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 116.726 -1.606 . . . . 0.0 111.763 177.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -65.28 -46.29 81.06 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 121.36 1.891 . . . . 0.0 110.341 176.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.32 0.5 OUTLIER -63.27 -18.72 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.403 0 C-N-CA 125.161 1.384 . . . . 0.0 113.804 177.278 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -89.48 -37.91 14.42 Favored 'General case' 0 CA--C 1.572 1.818 0 C-N-CA 127.116 2.166 . . . . 0.0 107.426 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -66.06 -44.67 83.88 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 126.457 1.903 . . . . 0.0 114.546 177.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -66.07 -52.0 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 107.07 -1.455 . . . . 0.0 107.07 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -60.58 -30.57 69.89 Favored 'General case' 0 CA--C 1.572 1.805 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.329 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -69.93 -49.86 47.72 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-N 119.768 1.167 . . . . 0.0 111.609 177.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -49.67 -57.25 7.58 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 115.368 1.618 . . . . 0.0 115.368 177.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.253 12.7 pt20 -64.9 -33.31 75.7 Favored 'General case' 0 CA--C 1.562 1.416 0 N-CA-C 116.553 2.057 . . . . 0.0 116.553 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -68.06 -36.47 79.92 Favored 'General case' 0 CA--C 1.564 1.513 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.1 mt -58.73 -58.97 6.25 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.682 1.193 . . . . 0.0 113.721 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -88.49 33.54 0.76 Allowed 'General case' 0 CA--C 1.572 1.797 0 N-CA-C 115.483 1.661 . . . . 0.0 115.483 177.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 84.5 tttt . . . . . 0 CA--C 1.56 1.329 0 O-C-N 120.947 -1.095 . . . . 0.0 112.892 -179.946 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.14 0 N-CA-C 102.803 -3.036 . . . . 0.0 102.803 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -145.45 60.2 1.28 Allowed 'General case' 0 CA--C 1.557 1.23 0 CA-C-O 122.607 1.194 . . . . 0.0 111.64 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -144.31 -59.74 0.38 Allowed 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 106.255 -1.758 . . . . 0.0 106.255 177.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.9 mtt -71.92 17.08 0.1 Allowed 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 177.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.8 mt -83.82 -75.52 0.33 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.938 2.095 . . . . 0.0 105.671 177.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -72.55 -33.76 67.05 Favored 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.121 176.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -66.87 -39.01 87.39 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-O 116.34 -1.79 . . . . 0.0 111.16 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -63.69 -46.35 85.93 Favored 'General case' 0 N--CA 1.501 2.107 0 CA-C-N 121.857 2.117 . . . . 0.0 110.561 176.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.321 0.5 OUTLIER -63.45 -15.91 17.13 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.438 0 C-N-CA 125.286 1.434 . . . . 0.0 114.349 177.376 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -92.98 -40.95 10.27 Favored 'General case' 0 CA--C 1.571 1.783 0 C-N-CA 127.452 2.301 . . . . 0.0 106.717 176.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -62.28 -41.83 98.82 Favored 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 126.453 1.901 . . . . 0.0 115.004 177.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.277 1.8 mp -65.78 -51.89 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -60.56 -31.72 70.82 Favored 'General case' 0 CA--C 1.572 1.804 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.414 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.9 tmmm? -70.17 -51.04 34.32 Favored 'General case' 0 CA--C 1.568 1.635 0 CA-C-N 119.305 0.957 . . . . 0.0 111.524 177.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -49.51 -57.57 6.8 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 114.911 1.449 . . . . 0.0 114.911 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.263 10.7 pt20 -62.98 -31.81 73.01 Favored 'General case' 0 CA--C 1.562 1.431 0 N-CA-C 116.034 1.865 . . . . 0.0 116.034 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -68.43 -34.6 76.28 Favored 'General case' 0 CA--C 1.565 1.531 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 177.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.1 mt -55.11 -61.57 2.23 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 177.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -75.22 -56.86 4.31 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 124.972 1.309 . . . . 0.0 113.671 177.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? . . . . . 0 CA--C 1.554 1.117 0 C-N-CA 124.098 0.959 . . . . 0.0 108.943 178.416 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 N-CA-C 104.373 -2.455 . . . . 0.0 104.373 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.51 57.01 1.65 Allowed 'General case' 0 CA--C 1.558 1.284 0 CA-C-O 122.532 1.158 . . . . 0.0 112.584 -179.267 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 10.8 p-10 -139.32 -56.5 0.59 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.384 1.474 . . . . 0.0 108.109 177.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.7 mtt -75.56 19.15 0.2 Allowed 'General case' 0 CA--C 1.577 1.984 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 177.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.6 mt -86.24 -74.71 0.41 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.13 2.172 . . . . 0.0 106.103 177.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -69.6 -34.77 74.57 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.846 176.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.26 -39.56 89.54 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-O 116.309 -1.805 . . . . 0.0 110.654 177.007 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -62.78 -46.98 85.47 Favored 'General case' 0 N--CA 1.501 2.079 0 CA-C-N 121.764 2.075 . . . . 0.0 110.525 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.61 -14.23 14.36 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.405 0 C-N-CA 125.304 1.442 . . . . 0.0 114.659 177.427 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -95.21 -38.36 10.61 Favored 'General case' 0 CA--C 1.575 1.927 0 C-N-CA 127.609 2.364 . . . . 0.0 107.029 176.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -63.19 -40.74 98.36 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 126.629 1.972 . . . . 0.0 115.422 177.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.8 mp -65.32 -54.32 30.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 177.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -62.54 -28.38 69.82 Favored 'General case' 0 CA--C 1.574 1.886 0 CA-C-O 117.813 -1.089 . . . . 0.0 111.459 176.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -71.03 -47.68 57.21 Favored 'General case' 0 CA--C 1.568 1.64 0 CA-C-N 119.922 1.237 . . . . 0.0 112.023 177.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -50.83 -54.32 24.74 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 177.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -78.05 -28.77 49.01 Favored 'General case' 0 CA--C 1.566 1.585 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -148.73 82.03 1.45 Allowed 'General case' 0 CA--C 1.566 1.595 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.0 mt -46.6 -41.87 15.23 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 116.926 2.195 . . . . 0.0 116.926 177.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -61.47 -45.44 94.23 Favored 'General case' 0 CA--C 1.566 1.594 0 C-N-CA 125.948 1.699 . . . . 0.0 114.665 177.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 86.6 tttt . . . . . 0 CA--C 1.557 1.237 0 C-N-CA 124.68 1.192 . . . . 0.0 110.471 178.016 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.453 0 N-CA-C 106.141 -1.8 . . . . 0.0 106.141 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.3 mmt -139.64 60.26 1.57 Allowed 'General case' 0 CA--C 1.563 1.454 0 C-N-CA 125.285 1.434 . . . . 0.0 110.901 -179.232 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -136.56 -53.09 0.72 Allowed 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.796 1.638 . . . . 0.0 107.782 177.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt -76.98 29.4 0.13 Allowed 'General case' 0 CA--C 1.583 2.218 0 CA-C-N 119.562 1.074 . . . . 0.0 112.666 176.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.321 3.2 pp -82.48 -60.16 2.29 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 125.536 1.534 . . . . 0.0 107.9 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.65 -37.75 20.65 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 125.552 1.541 . . . . 0.0 109.853 176.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.63 -39.15 93.64 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 116.925 -1.512 . . . . 0.0 111.62 177.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -64.59 -46.37 82.99 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 121.164 1.802 . . . . 0.0 110.644 176.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -63.35 -19.37 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.457 0 C-N-CA 125.149 1.38 . . . . 0.0 113.569 177.261 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -88.96 -36.59 15.79 Favored 'General case' 0 CA--C 1.573 1.858 0 C-N-CA 127.094 2.158 . . . . 0.0 107.678 176.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -66.11 -45.21 81.94 Favored 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 126.488 1.915 . . . . 0.0 114.338 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.281 1.9 mp -66.96 -51.49 54.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 177.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -60.26 -29.88 69.07 Favored 'General case' 0 CA--C 1.572 1.824 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.117 176.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -64.77 -61.39 2.21 Favored 'General case' 0 CA--C 1.567 1.622 0 CA-C-N 119.515 1.052 . . . . 0.0 110.526 177.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -47.16 -49.67 22.06 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 117.41 2.374 . . . . 0.0 117.41 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.288 4.9 tp-100 -49.9 -43.85 49.77 Favored 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 126.627 1.971 . . . . 0.0 115.303 177.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . 0.263 40.3 t30 135.8 91.48 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 127.08 2.152 . . . . 0.0 106.848 177.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.8 mt -55.95 -33.66 64.95 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 117.522 2.416 . . . . 0.0 117.522 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -69.18 -178.56 1.33 Allowed 'General case' 0 CA--C 1.574 1.883 0 C-N-CA 125.347 1.459 . . . . 0.0 114.187 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.2 tttm . . . . . 0 CA--C 1.561 1.379 0 O-C-N 120.776 -1.203 . . . . 0.0 112.709 -179.988 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 CA--C 1.552 1.029 0 N-CA-C 104.088 -2.56 . . . . 0.0 104.088 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 ttp 61.93 54.55 2.79 Favored 'General case' 0 CA--C 1.559 1.291 0 N-CA-C 116.269 1.951 . . . . 0.0 116.269 177.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . 0.284 12.1 p-10 -159.57 -69.54 0.08 Allowed 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.9 mtt -74.12 18.05 0.16 Allowed 'General case' 0 CA--C 1.573 1.865 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 177.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.6 mt -86.31 -74.6 0.41 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.464 1.906 . . . . 0.0 106.147 177.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -70.6 -34.05 71.73 Favored 'General case' 0 CA--C 1.563 1.451 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.959 176.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.92 -39.45 87.38 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 116.449 -1.739 . . . . 0.0 110.792 177.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -63.17 -46.75 85.7 Favored 'General case' 0 N--CA 1.501 2.1 0 CA-C-N 121.753 2.07 . . . . 0.0 110.698 176.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.02 -17.57 19.69 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.374 0 C-N-CA 125.26 1.424 . . . . 0.0 114.084 177.35 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -91.36 -39.12 12.2 Favored 'General case' 0 CA--C 1.57 1.738 0 C-N-CA 127.16 2.184 . . . . 0.0 107.182 176.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -62.02 -44.46 96.68 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 126.597 1.959 . . . . 0.0 115.311 177.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -64.32 -51.33 69.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 177.305 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -61.95 -33.4 74.22 Favored 'General case' 0 CA--C 1.57 1.733 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.973 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -68.82 -34.67 75.89 Favored 'General case' 0 CA--C 1.568 1.656 0 CA-C-N 119.946 1.248 . . . . 0.0 113.646 177.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -62.91 -50.79 69.47 Favored 'General case' 0 CA--C 1.562 1.423 0 N-CA-C 115.162 1.542 . . . . 0.0 115.162 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -79.45 -43.79 22.58 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 116.784 2.142 . . . . 0.0 116.784 -179.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -85.73 -36.61 20.08 Favored 'General case' 0 CA--C 1.563 1.456 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.258 3.5 mt 59.98 52.69 5.07 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 177.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.7 p90 -73.88 -43.08 59.65 Favored 'General case' 0 CA--C 1.56 1.358 0 N-CA-C 115.753 1.761 . . . . 0.0 115.753 177.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.0 tttp . . . . . 0 CA--C 1.556 1.2 0 CA-C-O 121.99 0.9 . . . . 0.0 110.837 -179.964 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.151 0 N-CA-C 103.192 -2.892 . . . . 0.0 103.192 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.3 63.17 1.28 Allowed 'General case' 0 CA--C 1.563 1.456 0 CA-C-O 122.8 1.285 . . . . 0.0 112.015 -179.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -144.24 -51.93 0.31 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 125.681 1.593 . . . . 0.0 107.705 177.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.2 ptp -78.47 29.33 0.19 Allowed 'General case' 0 CA--C 1.581 2.158 0 CA-C-N 119.785 1.175 . . . . 0.0 112.599 176.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.319 3.0 pp -82.45 -61.39 1.9 Allowed 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 125.811 1.644 . . . . 0.0 107.471 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.4 tttp -84.79 -37.62 20.57 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 125.49 1.516 . . . . 0.0 109.537 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.96 -38.84 92.72 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 116.583 -1.675 . . . . 0.0 111.519 177.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -64.12 -46.81 82.52 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 121.423 1.919 . . . . 0.0 110.093 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.318 0.5 OUTLIER -64.36 -11.89 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.481 0 C-N-CA 125.319 1.448 . . . . 0.0 114.6 177.285 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -98.34 -37.32 9.68 Favored 'General case' 0 CA--C 1.575 1.906 0 C-N-CA 127.913 2.485 . . . . 0.0 107.26 176.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -64.57 -41.25 96.41 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 126.577 1.951 . . . . 0.0 115.645 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.277 1.8 mp -64.68 -52.16 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 124.383 1.073 . . . . 0.0 108.105 177.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -64.05 -32.81 74.49 Favored 'General case' 0 CA--C 1.571 1.774 0 CA-C-O 117.792 -1.099 . . . . 0.0 110.67 176.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -65.8 -41.04 92.42 Favored 'General case' 0 CA--C 1.567 1.61 0 CA-C-N 120.057 1.299 . . . . 0.0 114.179 177.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -32.95 -46.38 0.15 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 119.252 3.056 . . . . 0.0 119.252 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -73.05 15.5 0.21 Allowed 'General case' 0 CA--C 1.575 1.914 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . 0.362 15.4 p30 63.43 65.98 0.72 Allowed 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 127.132 2.173 . . . . 0.0 112.841 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.7 mt -61.96 -52.99 61.78 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 177.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -75.92 177.36 7.06 Favored 'General case' 0 CA--C 1.573 1.851 0 C-N-CA 125.197 1.399 . . . . 0.0 113.347 178.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 85.3 tttt . . . . . 0 CA--C 1.556 1.195 0 O-C-N 120.959 -1.088 . . . . 0.0 110.559 179.07 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 102.854 -3.017 . . . . 0.0 102.854 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.72 61.25 1.33 Allowed 'General case' 0 CA--C 1.558 1.265 0 CA-C-O 122.807 1.289 . . . . 0.0 110.92 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -143.56 -58.08 0.4 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 177.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.3 mtp -67.78 5.31 0.88 Allowed 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 116.875 2.176 . . . . 0.0 116.875 177.331 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.1 mt -79.55 -78.26 0.16 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.844 2.057 . . . . 0.0 108.629 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -72.37 -33.24 67.1 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-O 117.707 -1.139 . . . . 0.0 112.588 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . 0.262 0.2 OUTLIER -67.42 -41.22 85.2 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 116.93 -1.51 . . . . 0.0 111.306 177.386 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -62.23 -46.31 89.42 Favored 'General case' 0 N--CA 1.501 2.117 0 CA-C-N 120.639 1.563 . . . . 0.0 111.267 176.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.325 0.5 OUTLIER -62.7 -21.44 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.323 0 C-N-CA 125.149 1.38 . . . . 0.0 113.665 177.325 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -87.14 -37.5 17.29 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 126.618 1.967 . . . . 0.0 107.54 176.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -64.07 -44.86 91.12 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 126.467 1.907 . . . . 0.0 114.638 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.272 1.8 mp -65.71 -52.47 49.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.328 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -61.15 -28.28 69.0 Favored 'General case' 0 CA--C 1.572 1.815 0 CA-C-O 118.006 -0.997 . . . . 0.0 111.789 176.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -72.47 -46.85 52.95 Favored 'General case' 0 CA--C 1.567 1.62 0 CA-C-N 119.929 1.241 . . . . 0.0 111.762 177.193 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -50.76 -54.18 25.6 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 114.363 1.246 . . . . 0.0 114.363 177.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -79.6 -21.48 44.93 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 116.239 1.94 . . . . 0.0 116.239 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -151.84 81.27 1.27 Allowed 'General case' 0 CA--C 1.568 1.644 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 12.6 mt -50.69 -35.88 33.21 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 117.463 2.394 . . . . 0.0 117.463 177.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 34.2 p90 -83.01 60.74 5.63 Favored 'General case' 0 CA--C 1.574 1.892 0 C-N-CA 126.249 1.82 . . . . 0.0 111.901 177.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.1 tttm . . . . . 0 CA--C 1.559 1.303 0 O-C-N 121.191 -0.943 . . . . 0.0 112.871 -179.84 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 102.942 -2.985 . . . . 0.0 102.942 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.38 63.16 1.33 Allowed 'General case' 0 CA--C 1.563 1.457 0 CA-C-O 122.909 1.338 . . . . 0.0 111.301 -179.346 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -142.01 -50.88 0.4 Allowed 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 125.896 1.679 . . . . 0.0 107.635 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 18.8 ptt? -78.92 29.59 0.21 Allowed 'General case' 0 CA--C 1.583 2.24 0 CA-C-N 119.838 1.199 . . . . 0.0 112.444 176.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.32 3.1 pp -83.16 -61.45 1.85 Allowed 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 125.827 1.651 . . . . 0.0 107.468 177.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -82.98 -37.25 24.29 Favored 'General case' 0 CA--C 1.561 1.402 0 C-N-CA 125.225 1.41 . . . . 0.0 109.641 176.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -63.01 -39.24 94.17 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 116.743 -1.598 . . . . 0.0 111.262 177.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -63.93 -46.76 83.3 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 121.23 1.832 . . . . 0.0 109.981 176.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.317 0.5 OUTLIER -65.26 -9.66 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.482 0 C-N-CA 125.323 1.449 . . . . 0.0 114.748 177.285 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -99.73 -37.37 9.13 Favored 'General case' 0 CA--C 1.577 1.99 0 C-N-CA 128.272 2.629 . . . . 0.0 107.066 176.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -65.5 -41.29 93.4 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 126.632 1.973 . . . . 0.0 115.278 177.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.276 1.8 mp -64.95 -53.52 40.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -61.98 -31.27 71.62 Favored 'General case' 0 CA--C 1.572 1.8 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.897 176.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -67.93 -50.69 54.56 Favored 'General case' 0 CA--C 1.567 1.628 0 CA-C-N 119.875 1.216 . . . . 0.0 111.664 177.135 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -49.12 -58.04 5.63 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 177.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.265 11.6 pt20 -63.0 -33.31 75.16 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 -179.493 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -71.88 -28.3 63.43 Favored 'General case' 0 CA--C 1.563 1.456 0 N-CA-C 114.669 1.359 . . . . 0.0 114.669 177.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.1 mt -60.41 -61.34 2.67 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 120.002 1.274 . . . . 0.0 113.77 177.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -73.26 -54.16 9.1 Favored 'General case' 0 CA--C 1.56 1.34 0 C-N-CA 124.612 1.165 . . . . 0.0 113.733 177.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? . . . . . 0 CA--C 1.553 1.095 0 C-N-CA 124.118 0.967 . . . . 0.0 108.775 177.996 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 103.65 -2.722 . . . . 0.0 103.65 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.8 ptt? -142.86 62.9 1.4 Allowed 'General case' 0 CA--C 1.557 1.218 0 CA-C-O 122.903 1.335 . . . . 0.0 111.87 -179.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -149.47 -61.78 0.22 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 105.797 -1.927 . . . . 0.0 105.797 177.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.8 mtt -71.19 17.46 0.08 Allowed 'General case' 0 CA--C 1.576 1.955 0 N-CA-C 115.894 1.813 . . . . 0.0 115.894 177.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 74.4 mt -80.59 -76.96 0.21 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.758 2.023 . . . . 0.0 105.666 177.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -75.58 -33.59 60.6 Favored 'General case' 0 CA--C 1.564 1.512 0 CA-C-O 117.806 -1.092 . . . . 0.0 110.789 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.29 -39.7 92.89 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 116.455 -1.736 . . . . 0.0 111.701 177.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -64.22 -45.96 85.94 Favored 'General case' 0 N--CA 1.501 2.101 0 CA-C-N 121.679 2.036 . . . . 0.0 110.669 176.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.48 -17.39 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.443 0 C-N-CA 125.279 1.432 . . . . 0.0 114.01 177.361 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -90.91 -40.09 11.91 Favored 'General case' 0 CA--C 1.57 1.722 0 C-N-CA 127.283 2.233 . . . . 0.0 107.069 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -63.2 -43.94 96.74 Favored 'General case' 0 CA--C 1.561 1.403 0 C-N-CA 126.414 1.886 . . . . 0.0 115.086 177.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.281 1.8 mp -65.93 -52.57 47.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 177.446 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -60.6 -30.19 69.67 Favored 'General case' 0 CA--C 1.572 1.806 0 CA-C-O 118.44 -0.79 . . . . 0.0 111.693 176.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -70.88 -51.39 26.64 Favored 'General case' 0 CA--C 1.565 1.521 0 CA-C-N 119.37 0.987 . . . . 0.0 111.46 177.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -48.51 -53.1 19.36 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -74.31 -28.39 61.15 Favored 'General case' 0 CA--C 1.566 1.561 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -138.07 68.42 1.4 Allowed 'General case' 0 CA--C 1.567 1.612 0 C-N-CA 124.141 0.977 . . . . 0.0 109.863 177.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 12.8 mt -56.16 -40.05 73.28 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 116.966 2.21 . . . . 0.0 116.966 177.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 49.7 p90 -68.13 176.38 2.72 Favored 'General case' 0 CA--C 1.575 1.905 0 C-N-CA 125.722 1.609 . . . . 0.0 114.11 177.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.3 tttm . . . . . 0 CA--C 1.557 1.228 0 O-C-N 121.001 -1.062 . . . . 0.0 110.688 179.055 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . 0.283 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.797 0 N-CA-C 101.481 -3.525 . . . . 0.0 101.481 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 13.1 mmt 55.8 57.27 5.34 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 115.672 1.731 . . . . 0.0 115.672 177.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . 0.275 13.2 p-10 -160.56 -66.14 0.07 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 177.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 33.1 mtm -72.92 13.87 0.34 Allowed 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 115.864 1.802 . . . . 0.0 115.864 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 84.3 mt -89.76 -69.81 0.7 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.361 2.264 . . . . 0.0 105.353 177.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -67.68 -35.51 78.97 Favored 'General case' 0 CA--C 1.563 1.469 0 C-N-CA 124.014 0.926 . . . . 0.0 111.661 176.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.74 -39.9 80.13 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 116.501 -1.714 . . . . 0.0 109.967 176.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -62.1 -46.79 87.51 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-N 121.542 1.974 . . . . 0.0 110.962 176.562 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.324 0.5 OUTLIER -62.48 -21.64 27.67 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.381 0 C-N-CA 125.174 1.39 . . . . 0.0 113.687 177.35 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -86.48 -37.84 17.88 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 126.692 1.997 . . . . 0.0 107.623 176.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -64.95 -44.77 88.32 Favored 'General case' 0 CA--C 1.562 1.416 0 C-N-CA 126.418 1.887 . . . . 0.0 114.701 177.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.8 mp -66.17 -52.2 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 177.394 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -60.87 -30.06 69.92 Favored 'General case' 0 CA--C 1.572 1.821 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.391 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -68.94 -53.02 23.2 Favored 'General case' 0 CA--C 1.565 1.548 0 CA-C-N 119.725 1.148 . . . . 0.0 110.881 177.131 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -50.86 -50.78 56.13 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.256 3.9 tp-100 -63.09 -45.5 91.79 Favored 'General case' 0 CA--C 1.564 1.481 0 C-N-CA 126.527 1.931 . . . . 0.0 115.51 177.731 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -129.93 67.0 1.47 Allowed 'General case' 0 CA--C 1.564 1.513 0 C-N-CA 124.272 1.029 . . . . 0.0 112.0 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 12.0 mt -53.92 -49.63 68.19 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 115.541 1.682 . . . . 0.0 115.541 177.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.9 p90 -87.2 60.14 5.98 Favored 'General case' 0 CA--C 1.57 1.741 0 C-N-CA 126.335 1.854 . . . . 0.0 112.24 177.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.5 tttp . . . . . 0 N--CA 1.483 1.222 0 O-C-N 120.903 -1.123 . . . . 0.0 111.569 -179.806 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 103.937 -2.616 . . . . 0.0 103.937 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.27 55.02 1.76 Allowed 'General case' 0 CA--C 1.558 1.266 0 CA-C-O 122.405 1.098 . . . . 0.0 112.946 -179.271 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -137.82 -59.65 0.65 Allowed 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.5 mtt -71.89 17.14 0.1 Allowed 'General case' 0 CA--C 1.575 1.91 0 N-CA-C 116.094 1.886 . . . . 0.0 116.094 177.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 81.2 mt -83.9 -75.22 0.34 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.76 2.024 . . . . 0.0 105.717 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -72.53 -33.93 67.2 Favored 'General case' 0 CA--C 1.561 1.391 0 CA-C-O 117.955 -1.022 . . . . 0.0 111.07 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -66.73 -39.21 87.89 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 116.502 -1.713 . . . . 0.0 111.216 177.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -63.79 -46.3 85.81 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 121.695 2.043 . . . . 0.0 110.799 176.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -62.75 -20.22 24.82 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.369 0 C-N-CA 125.154 1.382 . . . . 0.0 113.746 177.292 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -87.82 -38.87 15.33 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 126.937 2.095 . . . . 0.0 107.347 176.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -64.54 -44.87 89.46 Favored 'General case' 0 CA--C 1.561 1.378 0 C-N-CA 126.351 1.86 . . . . 0.0 114.992 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.8 mp -65.69 -52.19 53.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.412 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -60.76 -31.72 71.05 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.367 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -69.79 -49.5 52.22 Favored 'General case' 0 CA--C 1.564 1.516 0 CA-C-N 119.737 1.153 . . . . 0.0 111.877 177.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -47.02 -53.92 11.4 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 115.787 1.773 . . . . 0.0 115.787 177.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.25 7.3 pt20 -70.43 -32.9 70.68 Favored 'General case' 0 CA--C 1.56 1.363 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -179.532 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 29.2 p30 -71.69 -27.45 63.05 Favored 'General case' 0 CA--C 1.562 1.425 0 N-CA-C 116.894 2.183 . . . . 0.0 116.894 177.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.0 mt -55.92 -47.77 76.9 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -85.99 56.33 3.93 Favored 'General case' 0 CA--C 1.57 1.745 0 C-N-CA 125.013 1.325 . . . . 0.0 113.953 178.012 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.6 tttm . . . . . 0 N--CA 1.483 1.193 0 O-C-N 120.871 -1.143 . . . . 0.0 110.89 -179.974 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.134 0 N-CA-C 102.347 -3.205 . . . . 0.0 102.347 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.425 ' O ' ' SD ' ' A' ' 2' ' ' MET . 4.3 ppp? -144.48 51.95 1.26 Allowed 'General case' 0 CA--C 1.557 1.246 0 CA-C-O 122.227 1.013 . . . . 0.0 113.558 -179.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -138.91 -60.05 0.59 Allowed 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.3 mtp -72.1 17.21 0.1 Allowed 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 177.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 73.9 mt -81.17 -78.09 0.19 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.673 1.989 . . . . 0.0 106.306 177.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -72.93 -33.78 66.15 Favored 'General case' 0 CA--C 1.563 1.466 0 CA-C-O 117.769 -1.11 . . . . 0.0 110.894 176.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -64.69 -40.66 95.76 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 116.636 -1.65 . . . . 0.0 111.448 177.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -63.86 -46.3 85.61 Favored 'General case' 0 N--CA 1.501 2.121 0 CA-C-N 121.428 1.922 . . . . 0.0 110.785 176.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -62.83 -19.94 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.395 0 C-N-CA 125.255 1.422 . . . . 0.0 113.812 177.298 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -88.14 -37.12 16.44 Favored 'General case' 0 CA--C 1.573 1.839 0 C-N-CA 126.91 2.084 . . . . 0.0 107.508 176.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -65.6 -44.87 85.28 Favored 'General case' 0 CA--C 1.563 1.477 0 C-N-CA 126.428 1.891 . . . . 0.0 114.387 177.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -66.1 -51.71 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -60.22 -31.89 70.6 Favored 'General case' 0 CA--C 1.57 1.749 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.123 176.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -67.39 -51.63 49.56 Favored 'General case' 0 CA--C 1.567 1.62 0 CA-C-N 119.799 1.182 . . . . 0.0 111.762 177.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -48.89 -58.9 4.11 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.251 7.4 pt20 -62.68 -33.99 76.21 Favored 'General case' 0 CA--C 1.558 1.265 0 N-CA-C 117.076 2.25 . . . . 0.0 117.076 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -71.59 -27.89 63.44 Favored 'General case' 0 CA--C 1.561 1.393 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.0 mt -62.14 -62.06 2.04 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 120.114 1.324 . . . . 0.0 113.695 177.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -72.42 -55.15 7.5 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 124.605 1.162 . . . . 0.0 113.897 177.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 84.5 tttt . . . . . 0 CA--C 1.554 1.097 0 C-N-CA 124.121 0.969 . . . . 0.0 109.439 178.722 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 102.623 -3.103 . . . . 0.0 102.623 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.09 66.34 1.2 Allowed 'General case' 0 CA--C 1.564 1.491 0 CA-C-O 123.243 1.497 . . . . 0.0 111.084 -179.363 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -153.04 -54.07 0.11 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 125.863 1.665 . . . . 0.0 106.801 177.781 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 30.4 mtp -75.81 26.98 0.11 Allowed 'General case' 0 CA--C 1.583 2.22 0 CA-C-N 119.711 1.141 . . . . 0.0 113.002 176.97 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.312 2.8 pp -80.75 -61.51 1.95 Allowed 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 125.935 1.694 . . . . 0.0 107.906 177.956 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -86.67 -37.5 17.94 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.578 1.551 . . . . 0.0 109.5 176.925 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -63.0 -38.58 91.77 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-O 116.782 -1.58 . . . . 0.0 111.973 177.313 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -65.75 -46.15 79.94 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 121.339 1.881 . . . . 0.0 110.328 176.594 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.319 0.5 OUTLIER -64.06 -16.35 18.68 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.424 0 C-N-CA 125.201 1.4 . . . . 0.0 113.757 177.193 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -91.27 -39.11 12.26 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 127.452 2.301 . . . . 0.0 107.24 176.766 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -65.01 -47.91 75.8 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 126.406 1.882 . . . . 0.0 115.187 177.636 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.267 1.8 mp -65.93 -51.3 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 177.534 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -60.14 -32.64 71.21 Favored 'General case' 0 CA--C 1.567 1.634 0 CA-C-O 117.612 -1.185 . . . . 0.0 111.252 176.512 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -68.14 -52.16 37.84 Favored 'General case' 0 CA--C 1.567 1.607 0 CA-C-N 120.152 1.342 . . . . 0.0 111.679 177.214 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -46.76 -50.78 17.63 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 116.206 1.928 . . . . 0.0 116.206 177.795 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.271 12.2 pt20 -71.59 -36.28 70.81 Favored 'General case' 0 CA--C 1.559 1.313 0 N-CA-C 116.432 2.012 . . . . 0.0 116.432 -179.541 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.0 -19.4 63.33 Favored 'General case' 0 CA--C 1.567 1.598 0 N-CA-C 116.842 2.164 . . . . 0.0 116.842 177.703 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 23.2 mt -77.01 75.45 3.58 Favored 'General case' 0 CA--C 1.568 1.661 0 C-N-CA 124.428 1.091 . . . . 0.0 112.408 -179.938 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -85.45 -69.16 0.68 Allowed 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.436 -0.79 . . . . 0.0 113.025 -179.672 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 7.9 tmtm? . . . . . 0 N--CA 1.485 1.277 0 C-N-CA 123.792 0.837 . . . . 0.0 112.064 -179.902 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt . . . . . 0 CA--C 1.583 2.223 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.315 2.9 pp -81.31 -61.2 2.01 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 126.011 1.724 . . . . 0.0 107.917 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -85.28 -40.75 16.23 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 125.684 1.593 . . . . 0.0 108.865 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -59.99 -38.57 82.99 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 116.643 -1.646 . . . . 0.0 112.277 177.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -65.18 -47.34 77.31 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 121.375 1.898 . . . . 0.0 110.19 176.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.315 0.5 OUTLIER -63.18 -17.34 19.42 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.463 0 C-N-CA 125.304 1.442 . . . . 0.0 113.967 177.355 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -92.16 -37.27 12.82 Favored 'General case' 0 CA--C 1.571 1.775 0 C-N-CA 127.365 2.266 . . . . 0.0 107.364 176.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -64.1 -43.49 95.22 Favored 'General case' 0 CA--C 1.562 1.424 0 C-N-CA 126.462 1.905 . . . . 0.0 114.616 177.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -64.65 -51.1 71.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -62.1 -33.11 73.84 Favored 'General case' 0 CA--C 1.571 1.759 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.928 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt . . . . . 0 CA--C 1.569 1.711 0 CA-C-N 119.755 1.161 . . . . 0.0 113.568 177.281 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.7 mtt . . . . . 0 CA--C 1.575 1.916 0 N-CA-C 115.767 1.765 . . . . 0.0 115.767 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 76.8 mt -83.01 -77.25 0.25 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.494 1.918 . . . . 0.0 105.972 177.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -72.64 -34.07 67.03 Favored 'General case' 0 CA--C 1.565 1.523 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.836 176.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -65.66 -39.71 91.65 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-O 116.315 -1.802 . . . . 0.0 111.46 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.0 t30 -63.88 -45.26 90.21 Favored 'General case' 0 N--CA 1.501 2.123 0 CA-C-N 121.873 2.124 . . . . 0.0 110.6 176.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.321 0.5 OUTLIER -65.47 -10.43 10.05 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.501 0 C-N-CA 125.354 1.462 . . . . 0.0 114.587 177.306 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -99.3 -39.05 8.61 Favored 'General case' 0 CA--C 1.573 1.861 0 C-N-CA 128.108 2.563 . . . . 0.0 107.193 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -64.78 -44.84 88.71 Favored 'General case' 0 CA--C 1.561 1.371 0 C-N-CA 126.54 1.936 . . . . 0.0 115.123 177.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -65.5 -51.29 65.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 177.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.4 mm-40 -61.29 -31.16 70.99 Favored 'General case' 0 CA--C 1.57 1.742 0 CA-C-O 118.339 -0.838 . . . . 0.0 111.289 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 CA--C 1.565 1.555 0 CA-C-N 119.454 1.025 . . . . 0.0 111.337 177.174 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 18.8 ptt? . . . . . 0 CA--C 1.583 2.23 0 CA-C-O 120.871 0.367 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.31 2.9 pp -82.41 -60.95 2.03 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 125.811 1.644 . . . . 0.0 107.795 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -84.64 -38.79 19.41 Favored 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 125.712 1.605 . . . . 0.0 109.665 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.11 -38.43 91.16 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 116.469 -1.729 . . . . 0.0 111.658 177.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -64.53 -45.93 85.06 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-N 121.608 2.004 . . . . 0.0 109.945 176.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -65.92 -7.74 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.545 0 C-N-CA 125.329 1.451 . . . . 0.0 114.799 177.319 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -102.85 -36.9 8.07 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 128.397 2.679 . . . . 0.0 107.193 176.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -65.5 -41.17 93.51 Favored 'General case' 0 CA--C 1.56 1.356 0 C-N-CA 126.546 1.938 . . . . 0.0 115.545 177.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.28 1.8 mp -64.79 -53.55 40.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -62.24 -30.88 71.41 Favored 'General case' 0 CA--C 1.572 1.794 0 CA-C-O 117.99 -1.005 . . . . 0.0 111.129 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt . . . . . 0 CA--C 1.569 1.685 0 CA-C-N 119.905 1.229 . . . . 0.0 112.258 177.138 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.6 mtt . . . . . 0 CA--C 1.575 1.921 0 N-CA-C 115.839 1.792 . . . . 0.0 115.839 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 81.7 mt -84.13 -75.37 0.34 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.779 2.032 . . . . 0.0 105.961 177.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -71.73 -34.67 69.74 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 118.082 -0.961 . . . . 0.0 111.01 176.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.18 -39.52 89.77 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 116.341 -1.79 . . . . 0.0 111.13 177.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -63.63 -45.88 88.24 Favored 'General case' 0 N--CA 1.501 2.105 0 CA-C-N 121.842 2.11 . . . . 0.0 110.642 176.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -64.6 -12.92 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 C-N-CA 125.251 1.42 . . . . 0.0 114.469 177.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -96.3 -39.49 9.61 Favored 'General case' 0 CA--C 1.573 1.828 0 C-N-CA 127.71 2.404 . . . . 0.0 107.028 176.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -64.23 -44.21 92.58 Favored 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 126.598 1.959 . . . . 0.0 115.072 177.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.8 mp -64.37 -51.42 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 177.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.2 mm-40 -62.32 -32.97 73.8 Favored 'General case' 0 CA--C 1.57 1.733 0 CA-C-O 118.289 -0.862 . . . . 0.0 110.911 176.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt . . . . . 0 CA--C 1.571 1.752 0 CA-C-N 119.818 1.19 . . . . 0.0 113.182 177.155 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.1 mtt . . . . . 0 CA--C 1.58 2.131 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.321 3.0 pp -81.03 -60.61 2.23 Favored 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 125.531 1.532 . . . . 0.0 107.684 177.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -87.27 -37.77 16.9 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 125.591 1.556 . . . . 0.0 109.435 176.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -62.64 -38.52 90.58 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 116.508 -1.711 . . . . 0.0 111.729 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -64.61 -46.52 82.3 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 121.552 1.978 . . . . 0.0 109.977 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.319 0.5 OUTLIER -65.13 -9.99 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 C-N-CA 125.311 1.444 . . . . 0.0 114.707 177.269 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -100.24 -37.05 9.07 Favored 'General case' 0 CA--C 1.575 1.94 0 C-N-CA 128.223 2.609 . . . . 0.0 107.195 176.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -65.01 -40.97 95.69 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 126.544 1.938 . . . . 0.0 115.558 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.276 1.9 mp -65.35 -53.86 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 177.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -62.23 -29.0 70.08 Favored 'General case' 0 CA--C 1.572 1.81 0 CA-C-O 117.69 -1.148 . . . . 0.0 111.344 176.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.7 ttpt . . . . . 0 CA--C 1.57 1.73 0 CA-C-N 120.097 1.317 . . . . 0.0 112.101 177.102 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.7 mtt . . . . . 0 CA--C 1.574 1.894 0 N-CA-C 115.956 1.835 . . . . 0.0 115.956 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 73.1 mt -81.78 -77.02 0.23 Allowed 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 177.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -74.42 -33.78 63.07 Favored 'General case' 0 CA--C 1.565 1.537 0 CA-C-O 118.077 -0.963 . . . . 0.0 110.84 176.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.68 -39.7 91.58 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 116.287 -1.816 . . . . 0.0 111.399 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -63.31 -46.61 85.9 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-N 121.891 2.132 . . . . 0.0 110.43 176.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.62 -14.2 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.383 0 C-N-CA 125.301 1.44 . . . . 0.0 114.52 177.433 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -96.56 -36.56 10.71 Favored 'General case' 0 CA--C 1.573 1.853 0 C-N-CA 127.525 2.33 . . . . 0.0 107.269 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -63.09 -39.72 95.55 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 126.465 1.906 . . . . 0.0 115.55 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.9 mp -64.59 -53.98 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 177.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -63.55 -31.65 72.87 Favored 'General case' 0 CA--C 1.571 1.78 0 CA-C-O 117.902 -1.046 . . . . 0.0 110.881 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt . . . . . 0 CA--C 1.57 1.738 0 CA-C-N 120.363 1.438 . . . . 0.0 113.315 177.14 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt . . . . . 0 CA--C 1.582 2.185 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.317 3.0 pp -81.73 -60.12 2.36 Favored 'General case' 0 CA--C 1.559 1.323 0 C-N-CA 125.675 1.59 . . . . 0.0 108.187 177.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.05 -42.29 14.98 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 125.599 1.56 . . . . 0.0 108.656 176.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -59.15 -38.34 79.46 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 116.591 -1.671 . . . . 0.0 112.537 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -65.37 -47.17 77.32 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 121.404 1.911 . . . . 0.0 110.207 176.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.317 0.5 OUTLIER -63.16 -17.24 19.21 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.45 0 C-N-CA 125.337 1.455 . . . . 0.0 113.983 177.301 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -92.47 -36.43 13.09 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 127.445 2.298 . . . . 0.0 107.614 176.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -65.09 -43.84 90.81 Favored 'General case' 0 CA--C 1.563 1.459 0 C-N-CA 126.433 1.893 . . . . 0.0 114.395 177.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -64.63 -50.84 73.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -62.2 -33.46 74.59 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.779 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt . . . . . 0 CA--C 1.571 1.762 0 CA-C-N 119.921 1.237 . . . . 0.0 113.475 177.245 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.5 mtt . . . . . 0 CA--C 1.575 1.924 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 76.3 mt -82.75 -77.42 0.24 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.543 1.937 . . . . 0.0 105.935 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 tttp -72.6 -33.63 66.82 Favored 'General case' 0 CA--C 1.565 1.541 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.862 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.66 -40.4 92.39 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 116.517 -1.706 . . . . 0.0 111.279 177.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -63.87 -45.68 88.32 Favored 'General case' 0 N--CA 1.501 2.102 0 CA-C-N 121.623 2.01 . . . . 0.0 110.855 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -63.3 -18.94 22.78 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.433 0 C-N-CA 125.157 1.383 . . . . 0.0 113.741 177.306 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -88.89 -39.69 13.62 Favored 'General case' 0 CA--C 1.572 1.821 0 C-N-CA 126.983 2.113 . . . . 0.0 107.211 176.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -65.55 -44.27 87.32 Favored 'General case' 0 CA--C 1.563 1.465 0 C-N-CA 126.355 1.862 . . . . 0.0 114.828 177.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.7 mp -65.88 -52.15 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -60.79 -31.69 71.06 Favored 'General case' 0 CA--C 1.571 1.783 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.248 176.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 CA--C 1.567 1.6 0 CA-C-N 119.638 1.108 . . . . 0.0 111.995 177.168 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 32.9 mtm . . . . . 0 CA--C 1.583 2.236 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.311 2.9 pp -81.89 -61.17 1.99 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 125.847 1.659 . . . . 0.0 108.109 177.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -84.5 -38.6 19.89 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 125.609 1.564 . . . . 0.0 109.822 176.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.09 -38.58 91.74 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 116.726 -1.606 . . . . 0.0 111.763 177.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -65.28 -46.29 81.06 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 121.36 1.891 . . . . 0.0 110.341 176.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.32 0.5 OUTLIER -63.27 -18.72 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.403 0 C-N-CA 125.161 1.384 . . . . 0.0 113.804 177.278 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -89.48 -37.91 14.42 Favored 'General case' 0 CA--C 1.572 1.818 0 C-N-CA 127.116 2.166 . . . . 0.0 107.426 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -66.06 -44.67 83.88 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 126.457 1.903 . . . . 0.0 114.546 177.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -66.07 -52.0 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 107.07 -1.455 . . . . 0.0 107.07 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -60.58 -30.57 69.89 Favored 'General case' 0 CA--C 1.572 1.805 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.329 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt . . . . . 0 CA--C 1.567 1.618 0 CA-C-N 119.768 1.167 . . . . 0.0 111.609 177.136 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.9 mtt . . . . . 0 CA--C 1.575 1.927 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.8 mt -83.82 -75.52 0.33 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.938 2.095 . . . . 0.0 105.671 177.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -72.55 -33.76 67.05 Favored 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.121 176.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -66.87 -39.01 87.39 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-O 116.34 -1.79 . . . . 0.0 111.16 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -63.69 -46.35 85.93 Favored 'General case' 0 N--CA 1.501 2.107 0 CA-C-N 121.857 2.117 . . . . 0.0 110.561 176.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.321 0.5 OUTLIER -63.45 -15.91 17.13 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.438 0 C-N-CA 125.286 1.434 . . . . 0.0 114.349 177.376 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -92.98 -40.95 10.27 Favored 'General case' 0 CA--C 1.571 1.783 0 C-N-CA 127.452 2.301 . . . . 0.0 106.717 176.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -62.28 -41.83 98.82 Favored 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 126.453 1.901 . . . . 0.0 115.004 177.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.277 1.8 mp -65.78 -51.89 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -60.56 -31.72 70.82 Favored 'General case' 0 CA--C 1.572 1.804 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.414 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.9 tmmm? . . . . . 0 CA--C 1.568 1.635 0 CA-C-N 119.305 0.957 . . . . 0.0 111.524 177.307 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.7 mtt . . . . . 0 CA--C 1.577 1.984 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.6 mt -86.24 -74.71 0.41 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.13 2.172 . . . . 0.0 106.103 177.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -69.6 -34.77 74.57 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.846 176.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.26 -39.56 89.54 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-O 116.309 -1.805 . . . . 0.0 110.654 177.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -62.78 -46.98 85.47 Favored 'General case' 0 N--CA 1.501 2.079 0 CA-C-N 121.764 2.075 . . . . 0.0 110.525 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.61 -14.23 14.36 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.405 0 C-N-CA 125.304 1.442 . . . . 0.0 114.659 177.427 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -95.21 -38.36 10.61 Favored 'General case' 0 CA--C 1.575 1.927 0 C-N-CA 127.609 2.364 . . . . 0.0 107.029 176.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -63.19 -40.74 98.36 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 126.629 1.972 . . . . 0.0 115.422 177.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.8 mp -65.32 -54.32 30.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 177.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -62.54 -28.38 69.82 Favored 'General case' 0 CA--C 1.574 1.886 0 CA-C-O 117.813 -1.089 . . . . 0.0 111.459 176.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt . . . . . 0 CA--C 1.568 1.64 0 CA-C-N 119.922 1.237 . . . . 0.0 112.023 177.175 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt . . . . . 0 CA--C 1.583 2.218 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.321 3.2 pp -82.48 -60.16 2.29 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 125.536 1.534 . . . . 0.0 107.9 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.65 -37.75 20.65 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 125.552 1.541 . . . . 0.0 109.853 176.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.63 -39.15 93.64 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 116.925 -1.512 . . . . 0.0 111.62 177.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -64.59 -46.37 82.99 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 121.164 1.802 . . . . 0.0 110.644 176.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -63.35 -19.37 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.457 0 C-N-CA 125.149 1.38 . . . . 0.0 113.569 177.261 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -88.96 -36.59 15.79 Favored 'General case' 0 CA--C 1.573 1.858 0 C-N-CA 127.094 2.158 . . . . 0.0 107.678 176.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -66.11 -45.21 81.94 Favored 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 126.488 1.915 . . . . 0.0 114.338 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.281 1.9 mp -66.96 -51.49 54.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 177.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -60.26 -29.88 69.07 Favored 'General case' 0 CA--C 1.572 1.824 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.117 176.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 CA--C 1.567 1.622 0 CA-C-N 119.515 1.052 . . . . 0.0 110.526 177.049 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.9 mtt . . . . . 0 CA--C 1.573 1.865 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.6 mt -86.31 -74.6 0.41 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.464 1.906 . . . . 0.0 106.147 177.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -70.6 -34.05 71.73 Favored 'General case' 0 CA--C 1.563 1.451 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.959 176.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.92 -39.45 87.38 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 116.449 -1.739 . . . . 0.0 110.792 177.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -63.17 -46.75 85.7 Favored 'General case' 0 N--CA 1.501 2.1 0 CA-C-N 121.753 2.07 . . . . 0.0 110.698 176.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.02 -17.57 19.69 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.374 0 C-N-CA 125.26 1.424 . . . . 0.0 114.084 177.35 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -91.36 -39.12 12.2 Favored 'General case' 0 CA--C 1.57 1.738 0 C-N-CA 127.16 2.184 . . . . 0.0 107.182 176.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -62.02 -44.46 96.68 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 126.597 1.959 . . . . 0.0 115.311 177.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -64.32 -51.33 69.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 177.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -61.95 -33.4 74.22 Favored 'General case' 0 CA--C 1.57 1.733 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.973 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt . . . . . 0 CA--C 1.568 1.656 0 CA-C-N 119.946 1.248 . . . . 0.0 113.646 177.372 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.2 ptp . . . . . 0 CA--C 1.581 2.158 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.319 3.0 pp -82.45 -61.39 1.9 Allowed 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 125.811 1.644 . . . . 0.0 107.471 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.4 tttp -84.79 -37.62 20.57 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 125.49 1.516 . . . . 0.0 109.537 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.96 -38.84 92.72 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 116.583 -1.675 . . . . 0.0 111.519 177.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -64.12 -46.81 82.52 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 121.423 1.919 . . . . 0.0 110.093 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.318 0.5 OUTLIER -64.36 -11.89 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.481 0 C-N-CA 125.319 1.448 . . . . 0.0 114.6 177.285 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -98.34 -37.32 9.68 Favored 'General case' 0 CA--C 1.575 1.906 0 C-N-CA 127.913 2.485 . . . . 0.0 107.26 176.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -64.57 -41.25 96.41 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 126.577 1.951 . . . . 0.0 115.645 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.277 1.8 mp -64.68 -52.16 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 124.383 1.073 . . . . 0.0 108.105 177.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -64.05 -32.81 74.49 Favored 'General case' 0 CA--C 1.571 1.774 0 CA-C-O 117.792 -1.099 . . . . 0.0 110.67 176.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt . . . . . 0 CA--C 1.567 1.61 0 CA-C-N 120.057 1.299 . . . . 0.0 114.179 177.356 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.3 mtp . . . . . 0 CA--C 1.571 1.775 0 N-CA-C 116.875 2.176 . . . . 0.0 116.875 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.1 mt -79.55 -78.26 0.16 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.844 2.057 . . . . 0.0 108.629 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -72.37 -33.24 67.1 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-O 117.707 -1.139 . . . . 0.0 112.588 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . 0.262 0.2 OUTLIER -67.42 -41.22 85.2 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 116.93 -1.51 . . . . 0.0 111.306 177.386 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -62.23 -46.31 89.42 Favored 'General case' 0 N--CA 1.501 2.117 0 CA-C-N 120.639 1.563 . . . . 0.0 111.267 176.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.325 0.5 OUTLIER -62.7 -21.44 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.323 0 C-N-CA 125.149 1.38 . . . . 0.0 113.665 177.325 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -87.14 -37.5 17.29 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 126.618 1.967 . . . . 0.0 107.54 176.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -64.07 -44.86 91.12 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 126.467 1.907 . . . . 0.0 114.638 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.272 1.8 mp -65.71 -52.47 49.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -61.15 -28.28 69.0 Favored 'General case' 0 CA--C 1.572 1.815 0 CA-C-O 118.006 -0.997 . . . . 0.0 111.789 176.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt . . . . . 0 CA--C 1.567 1.62 0 CA-C-N 119.929 1.241 . . . . 0.0 111.762 177.193 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 18.8 ptt? . . . . . 0 CA--C 1.583 2.24 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.32 3.1 pp -83.16 -61.45 1.85 Allowed 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 125.827 1.651 . . . . 0.0 107.468 177.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -82.98 -37.25 24.29 Favored 'General case' 0 CA--C 1.561 1.402 0 C-N-CA 125.225 1.41 . . . . 0.0 109.641 176.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -63.01 -39.24 94.17 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 116.743 -1.598 . . . . 0.0 111.262 177.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -63.93 -46.76 83.3 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 121.23 1.832 . . . . 0.0 109.981 176.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.317 0.5 OUTLIER -65.26 -9.66 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.482 0 C-N-CA 125.323 1.449 . . . . 0.0 114.748 177.285 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -99.73 -37.37 9.13 Favored 'General case' 0 CA--C 1.577 1.99 0 C-N-CA 128.272 2.629 . . . . 0.0 107.066 176.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -65.5 -41.29 93.4 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 126.632 1.973 . . . . 0.0 115.278 177.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.276 1.8 mp -64.95 -53.52 40.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -61.98 -31.27 71.62 Favored 'General case' 0 CA--C 1.572 1.8 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.897 176.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt . . . . . 0 CA--C 1.567 1.628 0 CA-C-N 119.875 1.216 . . . . 0.0 111.664 177.135 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.8 mtt . . . . . 0 CA--C 1.576 1.955 0 N-CA-C 115.894 1.813 . . . . 0.0 115.894 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 74.4 mt -80.59 -76.96 0.21 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.758 2.023 . . . . 0.0 105.666 177.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -75.58 -33.59 60.6 Favored 'General case' 0 CA--C 1.564 1.512 0 CA-C-O 117.806 -1.092 . . . . 0.0 110.789 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.29 -39.7 92.89 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 116.455 -1.736 . . . . 0.0 111.701 177.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -64.22 -45.96 85.94 Favored 'General case' 0 N--CA 1.501 2.101 0 CA-C-N 121.679 2.036 . . . . 0.0 110.669 176.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.48 -17.39 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.443 0 C-N-CA 125.279 1.432 . . . . 0.0 114.01 177.361 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -90.91 -40.09 11.91 Favored 'General case' 0 CA--C 1.57 1.722 0 C-N-CA 127.283 2.233 . . . . 0.0 107.069 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -63.2 -43.94 96.74 Favored 'General case' 0 CA--C 1.561 1.403 0 C-N-CA 126.414 1.886 . . . . 0.0 115.086 177.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.281 1.8 mp -65.93 -52.57 47.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 177.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.6 -30.19 69.67 Favored 'General case' 0 CA--C 1.572 1.806 0 CA-C-O 118.44 -0.79 . . . . 0.0 111.693 176.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt . . . . . 0 CA--C 1.565 1.521 0 CA-C-N 119.37 0.987 . . . . 0.0 111.46 177.262 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 33.1 mtm . . . . . 0 CA--C 1.574 1.872 0 N-CA-C 115.864 1.802 . . . . 0.0 115.864 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 84.3 mt -89.76 -69.81 0.7 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.361 2.264 . . . . 0.0 105.353 177.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -67.68 -35.51 78.97 Favored 'General case' 0 CA--C 1.563 1.469 0 C-N-CA 124.014 0.926 . . . . 0.0 111.661 176.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.74 -39.9 80.13 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 116.501 -1.714 . . . . 0.0 109.967 176.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -62.1 -46.79 87.51 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-N 121.542 1.974 . . . . 0.0 110.962 176.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.324 0.5 OUTLIER -62.48 -21.64 27.67 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.381 0 C-N-CA 125.174 1.39 . . . . 0.0 113.687 177.35 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -86.48 -37.84 17.88 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 126.692 1.997 . . . . 0.0 107.623 176.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -64.95 -44.77 88.32 Favored 'General case' 0 CA--C 1.562 1.416 0 C-N-CA 126.418 1.887 . . . . 0.0 114.701 177.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.8 mp -66.17 -52.2 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 177.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -60.87 -30.06 69.92 Favored 'General case' 0 CA--C 1.572 1.821 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.391 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt . . . . . 0 CA--C 1.565 1.548 0 CA-C-N 119.725 1.148 . . . . 0.0 110.881 177.131 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.5 mtt . . . . . 0 CA--C 1.575 1.91 0 N-CA-C 116.094 1.886 . . . . 0.0 116.094 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 81.2 mt -83.9 -75.22 0.34 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.76 2.024 . . . . 0.0 105.717 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -72.53 -33.93 67.2 Favored 'General case' 0 CA--C 1.561 1.391 0 CA-C-O 117.955 -1.022 . . . . 0.0 111.07 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -66.73 -39.21 87.89 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 116.502 -1.713 . . . . 0.0 111.216 177.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -63.79 -46.3 85.81 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 121.695 2.043 . . . . 0.0 110.799 176.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -62.75 -20.22 24.82 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.369 0 C-N-CA 125.154 1.382 . . . . 0.0 113.746 177.292 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -87.82 -38.87 15.33 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 126.937 2.095 . . . . 0.0 107.347 176.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -64.54 -44.87 89.46 Favored 'General case' 0 CA--C 1.561 1.378 0 C-N-CA 126.351 1.86 . . . . 0.0 114.992 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.8 mp -65.69 -52.19 53.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -60.76 -31.72 71.05 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.367 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm . . . . . 0 CA--C 1.564 1.516 0 CA-C-N 119.737 1.153 . . . . 0.0 111.877 177.245 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.3 mtp . . . . . 0 CA--C 1.575 1.908 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 73.9 mt -81.17 -78.09 0.19 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.673 1.989 . . . . 0.0 106.306 177.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -72.93 -33.78 66.15 Favored 'General case' 0 CA--C 1.563 1.466 0 CA-C-O 117.769 -1.11 . . . . 0.0 110.894 176.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -64.69 -40.66 95.76 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 116.636 -1.65 . . . . 0.0 111.448 177.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -63.86 -46.3 85.61 Favored 'General case' 0 N--CA 1.501 2.121 0 CA-C-N 121.428 1.922 . . . . 0.0 110.785 176.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -62.83 -19.94 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.395 0 C-N-CA 125.255 1.422 . . . . 0.0 113.812 177.298 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -88.14 -37.12 16.44 Favored 'General case' 0 CA--C 1.573 1.839 0 C-N-CA 126.91 2.084 . . . . 0.0 107.508 176.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -65.6 -44.87 85.28 Favored 'General case' 0 CA--C 1.563 1.477 0 C-N-CA 126.428 1.891 . . . . 0.0 114.387 177.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -66.1 -51.71 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -60.22 -31.89 70.6 Favored 'General case' 0 CA--C 1.57 1.749 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.123 176.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 CA--C 1.567 1.62 0 CA-C-N 119.799 1.182 . . . . 0.0 111.762 177.179 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 30.4 mtp . . . . . 0 CA--C 1.583 2.22 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.312 2.8 pp -80.75 -61.51 1.95 Allowed 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 125.935 1.694 . . . . 0.0 107.906 177.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -86.67 -37.5 17.94 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.578 1.551 . . . . 0.0 109.5 176.925 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -63.0 -38.58 91.77 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-O 116.782 -1.58 . . . . 0.0 111.973 177.313 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -65.75 -46.15 79.94 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 121.339 1.881 . . . . 0.0 110.328 176.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.319 0.5 OUTLIER -64.06 -16.35 18.68 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.424 0 C-N-CA 125.201 1.4 . . . . 0.0 113.757 177.193 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -91.27 -39.11 12.26 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 127.452 2.301 . . . . 0.0 107.24 176.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -65.01 -47.91 75.8 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 126.406 1.882 . . . . 0.0 115.187 177.636 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.267 1.8 mp -65.93 -51.3 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 177.534 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -60.14 -32.64 71.21 Favored 'General case' 0 CA--C 1.567 1.634 0 CA-C-O 117.612 -1.185 . . . . 0.0 111.252 176.512 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm . . . . . 0 CA--C 1.567 1.607 0 CA-C-N 120.152 1.342 . . . . 0.0 111.679 177.214 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 103.399 -2.815 . . . . 0.0 103.399 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -146.56 65.32 1.19 Allowed 'General case' 0 CA--C 1.562 1.44 0 CA-C-O 122.934 1.35 . . . . 0.0 111.778 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -152.1 -52.44 0.12 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 125.803 1.641 . . . . 0.0 107.815 177.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt -77.86 28.21 0.17 Allowed 'General case' 0 CA--C 1.583 2.223 0 CA-C-N 119.531 1.06 . . . . 0.0 112.455 176.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.315 2.9 pp -81.31 -61.2 2.01 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 126.011 1.724 . . . . 0.0 107.917 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -85.28 -40.75 16.23 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 125.684 1.593 . . . . 0.0 108.865 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -59.99 -38.57 82.99 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 116.643 -1.646 . . . . 0.0 112.277 177.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -65.18 -47.34 77.31 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 121.375 1.898 . . . . 0.0 110.19 176.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.315 0.5 OUTLIER -63.18 -17.34 19.42 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.463 0 C-N-CA 125.304 1.442 . . . . 0.0 113.967 177.355 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -92.16 -37.27 12.82 Favored 'General case' 0 CA--C 1.571 1.775 0 C-N-CA 127.365 2.266 . . . . 0.0 107.364 176.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -64.1 -43.49 95.22 Favored 'General case' 0 CA--C 1.562 1.424 0 C-N-CA 126.462 1.905 . . . . 0.0 114.616 177.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -64.65 -51.1 71.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -62.1 -33.11 73.84 Favored 'General case' 0 CA--C 1.571 1.759 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.928 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -68.1 -34.42 76.37 Favored 'General case' 0 CA--C 1.569 1.711 0 CA-C-N 119.755 1.161 . . . . 0.0 113.568 177.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -61.62 -51.56 68.0 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 115.198 1.555 . . . . 0.0 115.198 177.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -79.67 -43.55 22.56 Favored 'General case' 0 CA--C 1.56 1.356 0 N-CA-C 116.698 2.11 . . . . 0.0 116.698 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -85.23 -35.96 21.25 Favored 'General case' 0 CA--C 1.564 1.496 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.0 mt 58.75 60.91 2.34 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 114.911 1.449 . . . . 0.0 114.911 177.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -87.24 56.15 3.85 Favored 'General case' 0 CA--C 1.57 1.741 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm . . . . . 0 N--CA 1.483 1.188 0 O-C-N 120.951 -1.093 . . . . 0.0 110.887 -179.936 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.243 0 N-CA-C 103.747 -2.686 . . . . 0.0 103.747 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -142.66 60.63 1.43 Allowed 'General case' 0 CA--C 1.557 1.229 0 CA-C-O 122.827 1.299 . . . . 0.0 111.358 -179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -143.44 -60.84 0.41 Allowed 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 177.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.7 mtt -73.16 19.3 0.09 Allowed 'General case' 0 CA--C 1.575 1.916 0 N-CA-C 115.767 1.765 . . . . 0.0 115.767 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 76.8 mt -83.01 -77.25 0.25 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.494 1.918 . . . . 0.0 105.972 177.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -72.64 -34.07 67.03 Favored 'General case' 0 CA--C 1.565 1.523 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.836 176.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -65.66 -39.71 91.65 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-O 116.315 -1.802 . . . . 0.0 111.46 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.0 t30 -63.88 -45.26 90.21 Favored 'General case' 0 N--CA 1.501 2.123 0 CA-C-N 121.873 2.124 . . . . 0.0 110.6 176.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.321 0.5 OUTLIER -65.47 -10.43 10.05 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.501 0 C-N-CA 125.354 1.462 . . . . 0.0 114.587 177.306 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -99.3 -39.05 8.61 Favored 'General case' 0 CA--C 1.573 1.861 0 C-N-CA 128.108 2.563 . . . . 0.0 107.193 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -64.78 -44.84 88.71 Favored 'General case' 0 CA--C 1.561 1.371 0 C-N-CA 126.54 1.936 . . . . 0.0 115.123 177.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -65.5 -51.29 65.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 177.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.4 mm-40 -61.29 -31.16 70.99 Favored 'General case' 0 CA--C 1.57 1.742 0 CA-C-O 118.339 -0.838 . . . . 0.0 111.289 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -68.33 -50.74 51.29 Favored 'General case' 0 CA--C 1.565 1.555 0 CA-C-N 119.454 1.025 . . . . 0.0 111.337 177.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -53.25 -53.34 52.26 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 114.911 1.449 . . . . 0.0 114.911 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.266 39.3 tp60 -57.42 -44.93 85.03 Favored 'General case' 0 CA--C 1.562 1.42 0 C-N-CA 126.841 2.056 . . . . 0.0 115.622 177.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -62.54 -37.19 85.15 Favored 'General case' 0 CA--C 1.565 1.536 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 177.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.7 mt -64.15 -22.14 66.82 Favored 'General case' 0 CA--C 1.563 1.442 0 N-CA-C 118.095 2.628 . . . . 0.0 118.095 177.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -77.76 76.92 4.28 Favored 'General case' 0 CA--C 1.573 1.86 0 C-N-CA 124.582 1.153 . . . . 0.0 112.864 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.6 tptm . . . . . 0 N--CA 1.485 1.291 0 O-C-N 120.769 -1.207 . . . . 0.0 110.757 -179.973 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 102.386 -3.19 . . . . 0.0 102.386 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.3 ptt? -149.11 65.82 1.03 Allowed 'General case' 0 CA--C 1.563 1.447 0 CA-C-O 122.615 1.198 . . . . 0.0 111.922 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -152.47 -53.42 0.12 Allowed 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 125.4 1.48 . . . . 0.0 107.893 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 18.8 ptt? -79.94 31.43 0.26 Allowed 'General case' 0 CA--C 1.583 2.23 0 CA-C-N 119.737 1.153 . . . . 0.0 111.836 176.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.31 2.9 pp -82.41 -60.95 2.03 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 125.811 1.644 . . . . 0.0 107.795 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -84.64 -38.79 19.41 Favored 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 125.712 1.605 . . . . 0.0 109.665 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.11 -38.43 91.16 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 116.469 -1.729 . . . . 0.0 111.658 177.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -64.53 -45.93 85.06 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-N 121.608 2.004 . . . . 0.0 109.945 176.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -65.92 -7.74 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.591 2.545 0 C-N-CA 125.329 1.451 . . . . 0.0 114.799 177.319 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -102.85 -36.9 8.07 Favored 'General case' 0 CA--C 1.576 1.977 0 C-N-CA 128.397 2.679 . . . . 0.0 107.193 176.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -65.5 -41.17 93.51 Favored 'General case' 0 CA--C 1.56 1.356 0 C-N-CA 126.546 1.938 . . . . 0.0 115.545 177.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.28 1.8 mp -64.79 -53.55 40.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -62.24 -30.88 71.41 Favored 'General case' 0 CA--C 1.572 1.794 0 CA-C-O 117.99 -1.005 . . . . 0.0 111.129 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -69.18 -46.62 67.06 Favored 'General case' 0 CA--C 1.569 1.685 0 CA-C-N 119.905 1.229 . . . . 0.0 112.258 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -50.61 -56.98 9.33 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 177.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -67.97 -31.45 71.18 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 116.27 1.952 . . . . 0.0 116.27 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.6 t30 -66.98 -37.29 83.97 Favored 'General case' 0 CA--C 1.563 1.455 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 177.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.6 mt -60.22 -61.49 2.57 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 124.553 1.141 . . . . 0.0 112.642 177.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 31.6 p90 -99.93 58.5 1.02 Allowed 'General case' 0 CA--C 1.57 1.727 0 C-N-CA 125.414 1.486 . . . . 0.0 110.692 177.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 44.8 tptt . . . . . 0 N--CA 1.483 1.185 0 O-C-N 120.954 -1.091 . . . . 0.0 111.947 -179.69 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 103.162 -2.903 . . . . 0.0 103.162 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -144.47 60.71 1.34 Allowed 'General case' 0 CA--C 1.557 1.236 0 CA-C-O 122.683 1.23 . . . . 0.0 111.372 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -143.76 -59.77 0.4 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 177.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.6 mtt -72.68 17.47 0.11 Allowed 'General case' 0 CA--C 1.575 1.921 0 N-CA-C 115.839 1.792 . . . . 0.0 115.839 177.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 81.7 mt -84.13 -75.37 0.34 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.779 2.032 . . . . 0.0 105.961 177.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -71.73 -34.67 69.74 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 118.082 -0.961 . . . . 0.0 111.01 176.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.18 -39.52 89.77 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 116.341 -1.79 . . . . 0.0 111.13 177.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -63.63 -45.88 88.24 Favored 'General case' 0 N--CA 1.501 2.105 0 CA-C-N 121.842 2.11 . . . . 0.0 110.642 176.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -64.6 -12.92 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 C-N-CA 125.251 1.42 . . . . 0.0 114.469 177.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -96.3 -39.49 9.61 Favored 'General case' 0 CA--C 1.573 1.828 0 C-N-CA 127.71 2.404 . . . . 0.0 107.028 176.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -64.23 -44.21 92.58 Favored 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 126.598 1.959 . . . . 0.0 115.072 177.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.8 mp -64.37 -51.42 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 177.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.2 mm-40 -62.32 -32.97 73.8 Favored 'General case' 0 CA--C 1.57 1.733 0 CA-C-O 118.289 -0.862 . . . . 0.0 110.911 176.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -67.41 -37.93 83.84 Favored 'General case' 0 CA--C 1.571 1.752 0 CA-C-N 119.818 1.19 . . . . 0.0 113.182 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -62.12 -53.18 59.08 Favored 'General case' 0 CA--C 1.559 1.316 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 177.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -77.61 -43.3 32.01 Favored 'General case' 0 CA--C 1.559 1.324 0 N-CA-C 117.268 2.321 . . . . 0.0 117.268 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -87.52 -33.75 18.85 Favored 'General case' 0 CA--C 1.559 1.307 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mt 56.42 71.06 0.59 Allowed 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 119.756 1.162 . . . . 0.0 113.626 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -76.92 79.03 3.49 Favored 'General case' 0 CA--C 1.574 1.88 0 C-N-CA 123.895 0.878 . . . . 0.0 113.062 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.4 tttp . . . . . 0 N--CA 1.487 1.395 0 O-C-N 120.836 -1.165 . . . . 0.0 112.268 -179.974 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.2 mmt -138.82 59.99 1.61 Allowed 'General case' 0 CA--C 1.563 1.45 0 C-N-CA 125.195 1.398 . . . . 0.0 111.282 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 -137.18 -53.82 0.69 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 125.74 1.616 . . . . 0.0 107.827 177.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.1 mtt -75.84 26.81 0.11 Allowed 'General case' 0 CA--C 1.58 2.131 0 CA-C-N 119.511 1.05 . . . . 0.0 113.283 177.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.321 3.0 pp -81.03 -60.61 2.23 Favored 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 125.531 1.532 . . . . 0.0 107.684 177.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -87.27 -37.77 16.9 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 125.591 1.556 . . . . 0.0 109.435 176.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -62.64 -38.52 90.58 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 116.508 -1.711 . . . . 0.0 111.729 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -64.61 -46.52 82.3 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 121.552 1.978 . . . . 0.0 109.977 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.319 0.5 OUTLIER -65.13 -9.99 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.49 0 C-N-CA 125.311 1.444 . . . . 0.0 114.707 177.269 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -100.24 -37.05 9.07 Favored 'General case' 0 CA--C 1.575 1.94 0 C-N-CA 128.223 2.609 . . . . 0.0 107.195 176.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -65.01 -40.97 95.69 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 126.544 1.938 . . . . 0.0 115.558 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.276 1.9 mp -65.35 -53.86 35.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 177.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -62.23 -29.0 70.08 Favored 'General case' 0 CA--C 1.572 1.81 0 CA-C-O 117.69 -1.148 . . . . 0.0 111.344 176.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.7 ttpt -71.34 -45.67 62.4 Favored 'General case' 0 CA--C 1.57 1.73 0 CA-C-N 120.097 1.317 . . . . 0.0 112.101 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.0 t30 -50.54 -54.1 25.09 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 177.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -79.78 -27.04 40.45 Favored 'General case' 0 CA--C 1.568 1.639 0 N-CA-C 116.248 1.944 . . . . 0.0 116.248 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -149.88 82.54 1.39 Allowed 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.3 mt -43.88 -40.43 4.54 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 177.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -59.73 -50.38 74.05 Favored 'General case' 0 CA--C 1.565 1.534 0 C-N-CA 125.694 1.598 . . . . 0.0 114.329 177.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.555 1.145 0 C-N-CA 124.917 1.287 . . . . 0.0 107.951 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.482 1.143 0 N-CA-C 102.733 -3.062 . . . . 0.0 102.733 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.77 55.89 1.49 Allowed 'General case' 0 CA--C 1.558 1.274 0 CA-C-O 122.488 1.137 . . . . 0.0 112.938 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -141.94 -61.19 0.46 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 177.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.7 mtt -72.12 19.0 0.08 Allowed 'General case' 0 CA--C 1.574 1.894 0 N-CA-C 115.956 1.835 . . . . 0.0 115.956 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 73.1 mt -81.78 -77.02 0.23 Allowed 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 177.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -74.42 -33.78 63.07 Favored 'General case' 0 CA--C 1.565 1.537 0 CA-C-O 118.077 -0.963 . . . . 0.0 110.84 176.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.68 -39.7 91.58 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 116.287 -1.816 . . . . 0.0 111.399 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -63.31 -46.61 85.9 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-N 121.891 2.132 . . . . 0.0 110.43 176.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.62 -14.2 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.383 0 C-N-CA 125.301 1.44 . . . . 0.0 114.52 177.433 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -96.56 -36.56 10.71 Favored 'General case' 0 CA--C 1.573 1.853 0 C-N-CA 127.525 2.33 . . . . 0.0 107.269 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -63.09 -39.72 95.55 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 126.465 1.906 . . . . 0.0 115.55 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.9 mp -64.59 -53.98 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 177.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -63.55 -31.65 72.87 Favored 'General case' 0 CA--C 1.571 1.78 0 CA-C-O 117.902 -1.046 . . . . 0.0 110.881 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -68.36 -34.52 76.22 Favored 'General case' 0 CA--C 1.57 1.738 0 CA-C-N 120.363 1.438 . . . . 0.0 113.315 177.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -61.68 -51.58 67.83 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 177.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -80.02 -42.45 23.79 Favored 'General case' 0 CA--C 1.56 1.364 0 N-CA-C 116.903 2.186 . . . . 0.0 116.903 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -85.0 -35.14 22.15 Favored 'General case' 0 CA--C 1.561 1.366 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.2 mt 56.64 53.45 8.42 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 115.858 1.799 . . . . 0.0 115.858 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -82.19 -178.38 7.0 Favored 'General case' 0 CA--C 1.572 1.81 0 C-N-CA 125.079 1.352 . . . . 0.0 113.168 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? . . . . . 0 CA--C 1.56 1.338 0 O-C-N 121.019 -1.051 . . . . 0.0 111.877 179.987 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 102.835 -3.024 . . . . 0.0 102.835 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -142.41 55.53 1.44 Allowed 'General case' 0 CA--C 1.565 1.521 0 CA-C-O 122.364 1.078 . . . . 0.0 113.554 -179.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -141.75 -52.6 0.43 Allowed 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.765 1.626 . . . . 0.0 107.536 177.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt -76.95 29.26 0.13 Allowed 'General case' 0 CA--C 1.582 2.185 0 CA-C-N 119.726 1.148 . . . . 0.0 112.644 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.317 3.0 pp -81.73 -60.12 2.36 Favored 'General case' 0 CA--C 1.559 1.323 0 C-N-CA 125.675 1.59 . . . . 0.0 108.187 177.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.05 -42.29 14.98 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 125.599 1.56 . . . . 0.0 108.656 176.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -59.15 -38.34 79.46 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 116.591 -1.671 . . . . 0.0 112.537 177.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -65.37 -47.17 77.32 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 121.404 1.911 . . . . 0.0 110.207 176.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.317 0.5 OUTLIER -63.16 -17.24 19.21 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.45 0 C-N-CA 125.337 1.455 . . . . 0.0 113.983 177.301 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -92.47 -36.43 13.09 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 127.445 2.298 . . . . 0.0 107.614 176.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -65.09 -43.84 90.81 Favored 'General case' 0 CA--C 1.563 1.459 0 C-N-CA 126.433 1.893 . . . . 0.0 114.395 177.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -64.63 -50.84 73.89 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -62.2 -33.46 74.59 Favored 'General case' 0 CA--C 1.57 1.74 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.779 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -67.02 -34.49 77.84 Favored 'General case' 0 CA--C 1.571 1.762 0 CA-C-N 119.921 1.237 . . . . 0.0 113.475 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -61.89 -51.58 67.61 Favored 'General case' 0 CA--C 1.561 1.378 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -79.33 -43.35 23.72 Favored 'General case' 0 CA--C 1.562 1.408 0 N-CA-C 116.842 2.164 . . . . 0.0 116.842 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -86.24 -32.75 20.98 Favored 'General case' 0 CA--C 1.561 1.383 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.253 4.3 mt 56.89 53.05 8.56 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 116.106 1.891 . . . . 0.0 116.106 177.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -84.03 -179.19 7.19 Favored 'General case' 0 CA--C 1.573 1.834 0 C-N-CA 125.052 1.341 . . . . 0.0 112.934 177.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? . . . . . 0 CA--C 1.56 1.353 0 O-C-N 121.001 -1.062 . . . . 0.0 112.299 179.682 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 102.764 -3.051 . . . . 0.0 102.764 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -144.76 60.26 1.32 Allowed 'General case' 0 CA--C 1.556 1.193 0 CA-C-O 122.644 1.211 . . . . 0.0 111.694 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -144.7 -60.82 0.37 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 177.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.5 mtt -73.08 19.46 0.09 Allowed 'General case' 0 CA--C 1.575 1.924 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 177.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 76.3 mt -82.75 -77.42 0.24 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.543 1.937 . . . . 0.0 105.935 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 tttp -72.6 -33.63 66.82 Favored 'General case' 0 CA--C 1.565 1.541 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.862 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.66 -40.4 92.39 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 116.517 -1.706 . . . . 0.0 111.279 177.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -63.87 -45.68 88.32 Favored 'General case' 0 N--CA 1.501 2.102 0 CA-C-N 121.623 2.01 . . . . 0.0 110.855 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -63.3 -18.94 22.78 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.433 0 C-N-CA 125.157 1.383 . . . . 0.0 113.741 177.306 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -88.89 -39.69 13.62 Favored 'General case' 0 CA--C 1.572 1.821 0 C-N-CA 126.983 2.113 . . . . 0.0 107.211 176.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -65.55 -44.27 87.32 Favored 'General case' 0 CA--C 1.563 1.465 0 C-N-CA 126.355 1.862 . . . . 0.0 114.828 177.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.7 mp -65.88 -52.15 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -60.79 -31.69 71.06 Favored 'General case' 0 CA--C 1.571 1.783 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.248 176.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -69.66 -49.07 57.21 Favored 'General case' 0 CA--C 1.567 1.6 0 CA-C-N 119.638 1.108 . . . . 0.0 111.995 177.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -50.25 -57.46 7.76 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 177.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.252 6.9 pt20 -65.92 -32.28 73.69 Favored 'General case' 0 CA--C 1.561 1.395 0 N-CA-C 116.797 2.147 . . . . 0.0 116.797 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.3 t30 -68.73 -36.91 79.0 Favored 'General case' 0 CA--C 1.563 1.477 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 177.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.1 mt -60.84 -61.83 2.3 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.637 1.175 . . . . 0.0 113.728 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -83.59 -176.93 6.54 Favored 'General case' 0 CA--C 1.572 1.819 0 C-N-CA 124.63 1.172 . . . . 0.0 112.764 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 85.1 tttt . . . . . 0 CA--C 1.557 1.213 0 O-C-N 121.053 -1.029 . . . . 0.0 111.023 179.975 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 103.097 -2.927 . . . . 0.0 103.097 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -147.46 65.05 1.14 Allowed 'General case' 0 CA--C 1.562 1.421 0 CA-C-O 122.774 1.273 . . . . 0.0 111.812 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -153.02 -54.36 0.11 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.72 1.608 . . . . 0.0 107.264 177.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 32.9 mtm -77.65 30.1 0.16 Allowed 'General case' 0 CA--C 1.583 2.236 0 CA-C-N 119.627 1.103 . . . . 0.0 112.142 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.311 2.9 pp -81.89 -61.17 1.99 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 125.847 1.659 . . . . 0.0 108.109 177.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -84.5 -38.6 19.89 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 125.609 1.564 . . . . 0.0 109.822 176.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.09 -38.58 91.74 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 116.726 -1.606 . . . . 0.0 111.763 177.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -65.28 -46.29 81.06 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 121.36 1.891 . . . . 0.0 110.341 176.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.32 0.5 OUTLIER -63.27 -18.72 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.403 0 C-N-CA 125.161 1.384 . . . . 0.0 113.804 177.278 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -89.48 -37.91 14.42 Favored 'General case' 0 CA--C 1.572 1.818 0 C-N-CA 127.116 2.166 . . . . 0.0 107.426 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -66.06 -44.67 83.88 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 126.457 1.903 . . . . 0.0 114.546 177.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.275 1.8 mp -66.07 -52.0 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 107.07 -1.455 . . . . 0.0 107.07 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -60.58 -30.57 69.89 Favored 'General case' 0 CA--C 1.572 1.805 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.329 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -69.93 -49.86 47.72 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-N 119.768 1.167 . . . . 0.0 111.609 177.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -49.67 -57.25 7.58 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 115.368 1.618 . . . . 0.0 115.368 177.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.253 12.7 pt20 -64.9 -33.31 75.7 Favored 'General case' 0 CA--C 1.562 1.416 0 N-CA-C 116.553 2.057 . . . . 0.0 116.553 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -68.06 -36.47 79.92 Favored 'General case' 0 CA--C 1.564 1.513 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 177.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.1 mt -58.73 -58.97 6.25 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.682 1.193 . . . . 0.0 113.721 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.3 p90 -88.49 33.54 0.76 Allowed 'General case' 0 CA--C 1.572 1.797 0 N-CA-C 115.483 1.661 . . . . 0.0 115.483 177.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 84.5 tttt . . . . . 0 CA--C 1.56 1.329 0 O-C-N 120.947 -1.095 . . . . 0.0 112.892 -179.946 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.14 0 N-CA-C 102.803 -3.036 . . . . 0.0 102.803 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -145.45 60.2 1.28 Allowed 'General case' 0 CA--C 1.557 1.23 0 CA-C-O 122.607 1.194 . . . . 0.0 111.64 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -144.31 -59.74 0.38 Allowed 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 106.255 -1.758 . . . . 0.0 106.255 177.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.9 mtt -71.92 17.08 0.1 Allowed 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 177.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.8 mt -83.82 -75.52 0.33 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.938 2.095 . . . . 0.0 105.671 177.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -72.55 -33.76 67.05 Favored 'General case' 0 CA--C 1.561 1.388 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.121 176.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -66.87 -39.01 87.39 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-O 116.34 -1.79 . . . . 0.0 111.16 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -63.69 -46.35 85.93 Favored 'General case' 0 N--CA 1.501 2.107 0 CA-C-N 121.857 2.117 . . . . 0.0 110.561 176.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.321 0.5 OUTLIER -63.45 -15.91 17.13 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.438 0 C-N-CA 125.286 1.434 . . . . 0.0 114.349 177.376 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -92.98 -40.95 10.27 Favored 'General case' 0 CA--C 1.571 1.783 0 C-N-CA 127.452 2.301 . . . . 0.0 106.717 176.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -62.28 -41.83 98.82 Favored 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 126.453 1.901 . . . . 0.0 115.004 177.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.277 1.8 mp -65.78 -51.89 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -60.56 -31.72 70.82 Favored 'General case' 0 CA--C 1.572 1.804 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.414 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.9 tmmm? -70.17 -51.04 34.32 Favored 'General case' 0 CA--C 1.568 1.635 0 CA-C-N 119.305 0.957 . . . . 0.0 111.524 177.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -49.51 -57.57 6.8 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 114.911 1.449 . . . . 0.0 114.911 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.263 10.7 pt20 -62.98 -31.81 73.01 Favored 'General case' 0 CA--C 1.562 1.431 0 N-CA-C 116.034 1.865 . . . . 0.0 116.034 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -68.43 -34.6 76.28 Favored 'General case' 0 CA--C 1.565 1.531 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 177.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.1 mt -55.11 -61.57 2.23 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 177.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -75.22 -56.86 4.31 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 124.972 1.309 . . . . 0.0 113.671 177.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? . . . . . 0 CA--C 1.554 1.117 0 C-N-CA 124.098 0.959 . . . . 0.0 108.943 178.416 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 N-CA-C 104.373 -2.455 . . . . 0.0 104.373 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.51 57.01 1.65 Allowed 'General case' 0 CA--C 1.558 1.284 0 CA-C-O 122.532 1.158 . . . . 0.0 112.584 -179.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 10.8 p-10 -139.32 -56.5 0.59 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.384 1.474 . . . . 0.0 108.109 177.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.7 mtt -75.56 19.15 0.2 Allowed 'General case' 0 CA--C 1.577 1.984 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 177.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.6 mt -86.24 -74.71 0.41 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.13 2.172 . . . . 0.0 106.103 177.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -69.6 -34.77 74.57 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.846 176.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -66.26 -39.56 89.54 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-O 116.309 -1.805 . . . . 0.0 110.654 177.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -62.78 -46.98 85.47 Favored 'General case' 0 N--CA 1.501 2.079 0 CA-C-N 121.764 2.075 . . . . 0.0 110.525 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.61 -14.23 14.36 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.405 0 C-N-CA 125.304 1.442 . . . . 0.0 114.659 177.427 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -95.21 -38.36 10.61 Favored 'General case' 0 CA--C 1.575 1.927 0 C-N-CA 127.609 2.364 . . . . 0.0 107.029 176.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -63.19 -40.74 98.36 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 126.629 1.972 . . . . 0.0 115.422 177.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.8 mp -65.32 -54.32 30.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 177.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -62.54 -28.38 69.82 Favored 'General case' 0 CA--C 1.574 1.886 0 CA-C-O 117.813 -1.089 . . . . 0.0 111.459 176.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -71.03 -47.68 57.21 Favored 'General case' 0 CA--C 1.568 1.64 0 CA-C-N 119.922 1.237 . . . . 0.0 112.023 177.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -50.83 -54.32 24.74 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 177.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -78.05 -28.77 49.01 Favored 'General case' 0 CA--C 1.566 1.585 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -148.73 82.03 1.45 Allowed 'General case' 0 CA--C 1.566 1.595 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.0 mt -46.6 -41.87 15.23 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 116.926 2.195 . . . . 0.0 116.926 177.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -61.47 -45.44 94.23 Favored 'General case' 0 CA--C 1.566 1.594 0 C-N-CA 125.948 1.699 . . . . 0.0 114.665 177.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 86.6 tttt . . . . . 0 CA--C 1.557 1.237 0 C-N-CA 124.68 1.192 . . . . 0.0 110.471 178.016 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.453 0 N-CA-C 106.141 -1.8 . . . . 0.0 106.141 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.3 mmt -139.64 60.26 1.57 Allowed 'General case' 0 CA--C 1.563 1.454 0 C-N-CA 125.285 1.434 . . . . 0.0 110.901 -179.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -136.56 -53.09 0.72 Allowed 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.796 1.638 . . . . 0.0 107.782 177.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 mtt -76.98 29.4 0.13 Allowed 'General case' 0 CA--C 1.583 2.218 0 CA-C-N 119.562 1.074 . . . . 0.0 112.666 176.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.321 3.2 pp -82.48 -60.16 2.29 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 125.536 1.534 . . . . 0.0 107.9 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.65 -37.75 20.65 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 125.552 1.541 . . . . 0.0 109.853 176.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.63 -39.15 93.64 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 116.925 -1.512 . . . . 0.0 111.62 177.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -64.59 -46.37 82.99 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 121.164 1.802 . . . . 0.0 110.644 176.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -63.35 -19.37 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.457 0 C-N-CA 125.149 1.38 . . . . 0.0 113.569 177.261 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -88.96 -36.59 15.79 Favored 'General case' 0 CA--C 1.573 1.858 0 C-N-CA 127.094 2.158 . . . . 0.0 107.678 176.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -66.11 -45.21 81.94 Favored 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 126.488 1.915 . . . . 0.0 114.338 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.281 1.9 mp -66.96 -51.49 54.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 177.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -60.26 -29.88 69.07 Favored 'General case' 0 CA--C 1.572 1.824 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.117 176.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -64.77 -61.39 2.21 Favored 'General case' 0 CA--C 1.567 1.622 0 CA-C-N 119.515 1.052 . . . . 0.0 110.526 177.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -47.16 -49.67 22.06 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 117.41 2.374 . . . . 0.0 117.41 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.288 4.9 tp-100 -49.9 -43.85 49.77 Favored 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 126.627 1.971 . . . . 0.0 115.303 177.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . 0.263 40.3 t30 135.8 91.48 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 127.08 2.152 . . . . 0.0 106.848 177.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.8 mt -55.95 -33.66 64.95 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 117.522 2.416 . . . . 0.0 117.522 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -69.18 -178.56 1.33 Allowed 'General case' 0 CA--C 1.574 1.883 0 C-N-CA 125.347 1.459 . . . . 0.0 114.187 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.2 tttm . . . . . 0 CA--C 1.561 1.379 0 O-C-N 120.776 -1.203 . . . . 0.0 112.709 -179.988 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 CA--C 1.552 1.029 0 N-CA-C 104.088 -2.56 . . . . 0.0 104.088 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 ttp 61.93 54.55 2.79 Favored 'General case' 0 CA--C 1.559 1.291 0 N-CA-C 116.269 1.951 . . . . 0.0 116.269 177.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . 0.284 12.1 p-10 -159.57 -69.54 0.08 Allowed 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.9 mtt -74.12 18.05 0.16 Allowed 'General case' 0 CA--C 1.573 1.865 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 177.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.6 mt -86.31 -74.6 0.41 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.464 1.906 . . . . 0.0 106.147 177.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -70.6 -34.05 71.73 Favored 'General case' 0 CA--C 1.563 1.451 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.959 176.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.92 -39.45 87.38 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 116.449 -1.739 . . . . 0.0 110.792 177.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -63.17 -46.75 85.7 Favored 'General case' 0 N--CA 1.501 2.1 0 CA-C-N 121.753 2.07 . . . . 0.0 110.698 176.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.02 -17.57 19.69 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.374 0 C-N-CA 125.26 1.424 . . . . 0.0 114.084 177.35 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -91.36 -39.12 12.2 Favored 'General case' 0 CA--C 1.57 1.738 0 C-N-CA 127.16 2.184 . . . . 0.0 107.182 176.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -62.02 -44.46 96.68 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 126.597 1.959 . . . . 0.0 115.311 177.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -64.32 -51.33 69.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 177.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -61.95 -33.4 74.22 Favored 'General case' 0 CA--C 1.57 1.733 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.973 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -68.82 -34.67 75.89 Favored 'General case' 0 CA--C 1.568 1.656 0 CA-C-N 119.946 1.248 . . . . 0.0 113.646 177.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -62.91 -50.79 69.47 Favored 'General case' 0 CA--C 1.562 1.423 0 N-CA-C 115.162 1.542 . . . . 0.0 115.162 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -79.45 -43.79 22.58 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 116.784 2.142 . . . . 0.0 116.784 -179.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -85.73 -36.61 20.08 Favored 'General case' 0 CA--C 1.563 1.456 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.258 3.5 mt 59.98 52.69 5.07 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 177.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.7 p90 -73.88 -43.08 59.65 Favored 'General case' 0 CA--C 1.56 1.358 0 N-CA-C 115.753 1.761 . . . . 0.0 115.753 177.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.0 tttp . . . . . 0 CA--C 1.556 1.2 0 CA-C-O 121.99 0.9 . . . . 0.0 110.837 -179.964 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.151 0 N-CA-C 103.192 -2.892 . . . . 0.0 103.192 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.3 63.17 1.28 Allowed 'General case' 0 CA--C 1.563 1.456 0 CA-C-O 122.8 1.285 . . . . 0.0 112.015 -179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -144.24 -51.93 0.31 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 125.681 1.593 . . . . 0.0 107.705 177.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.2 ptp -78.47 29.33 0.19 Allowed 'General case' 0 CA--C 1.581 2.158 0 CA-C-N 119.785 1.175 . . . . 0.0 112.599 176.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.319 3.0 pp -82.45 -61.39 1.9 Allowed 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 125.811 1.644 . . . . 0.0 107.471 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.4 tttp -84.79 -37.62 20.57 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 125.49 1.516 . . . . 0.0 109.537 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.96 -38.84 92.72 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 116.583 -1.675 . . . . 0.0 111.519 177.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -64.12 -46.81 82.52 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 121.423 1.919 . . . . 0.0 110.093 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.318 0.5 OUTLIER -64.36 -11.89 11.18 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.481 0 C-N-CA 125.319 1.448 . . . . 0.0 114.6 177.285 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -98.34 -37.32 9.68 Favored 'General case' 0 CA--C 1.575 1.906 0 C-N-CA 127.913 2.485 . . . . 0.0 107.26 176.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -64.57 -41.25 96.41 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 126.577 1.951 . . . . 0.0 115.645 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.277 1.8 mp -64.68 -52.16 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 124.383 1.073 . . . . 0.0 108.105 177.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -64.05 -32.81 74.49 Favored 'General case' 0 CA--C 1.571 1.774 0 CA-C-O 117.792 -1.099 . . . . 0.0 110.67 176.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -65.8 -41.04 92.42 Favored 'General case' 0 CA--C 1.567 1.61 0 CA-C-N 120.057 1.299 . . . . 0.0 114.179 177.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -32.95 -46.38 0.15 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 119.252 3.056 . . . . 0.0 119.252 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -73.05 15.5 0.21 Allowed 'General case' 0 CA--C 1.575 1.914 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . 0.362 15.4 p30 63.43 65.98 0.72 Allowed 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 127.132 2.173 . . . . 0.0 112.841 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.7 mt -61.96 -52.99 61.78 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 177.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -75.92 177.36 7.06 Favored 'General case' 0 CA--C 1.573 1.851 0 C-N-CA 125.197 1.399 . . . . 0.0 113.347 178.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 85.3 tttt . . . . . 0 CA--C 1.556 1.195 0 O-C-N 120.959 -1.088 . . . . 0.0 110.559 179.07 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 102.854 -3.017 . . . . 0.0 102.854 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.72 61.25 1.33 Allowed 'General case' 0 CA--C 1.558 1.265 0 CA-C-O 122.807 1.289 . . . . 0.0 110.92 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -143.56 -58.08 0.4 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 177.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.3 mtp -67.78 5.31 0.88 Allowed 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 116.875 2.176 . . . . 0.0 116.875 177.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.1 mt -79.55 -78.26 0.16 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.844 2.057 . . . . 0.0 108.629 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -72.37 -33.24 67.1 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-O 117.707 -1.139 . . . . 0.0 112.588 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . 0.262 0.2 OUTLIER -67.42 -41.22 85.2 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 116.93 -1.51 . . . . 0.0 111.306 177.386 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -62.23 -46.31 89.42 Favored 'General case' 0 N--CA 1.501 2.117 0 CA-C-N 120.639 1.563 . . . . 0.0 111.267 176.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.325 0.5 OUTLIER -62.7 -21.44 27.59 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.323 0 C-N-CA 125.149 1.38 . . . . 0.0 113.665 177.325 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -87.14 -37.5 17.29 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 126.618 1.967 . . . . 0.0 107.54 176.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -64.07 -44.86 91.12 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 126.467 1.907 . . . . 0.0 114.638 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.272 1.8 mp -65.71 -52.47 49.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -61.15 -28.28 69.0 Favored 'General case' 0 CA--C 1.572 1.815 0 CA-C-O 118.006 -0.997 . . . . 0.0 111.789 176.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -72.47 -46.85 52.95 Favored 'General case' 0 CA--C 1.567 1.62 0 CA-C-N 119.929 1.241 . . . . 0.0 111.762 177.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -50.76 -54.18 25.6 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 114.363 1.246 . . . . 0.0 114.363 177.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -79.6 -21.48 44.93 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 116.239 1.94 . . . . 0.0 116.239 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -151.84 81.27 1.27 Allowed 'General case' 0 CA--C 1.568 1.644 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 12.6 mt -50.69 -35.88 33.21 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 117.463 2.394 . . . . 0.0 117.463 177.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 34.2 p90 -83.01 60.74 5.63 Favored 'General case' 0 CA--C 1.574 1.892 0 C-N-CA 126.249 1.82 . . . . 0.0 111.901 177.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.1 tttm . . . . . 0 CA--C 1.559 1.303 0 O-C-N 121.191 -0.943 . . . . 0.0 112.871 -179.84 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 102.942 -2.985 . . . . 0.0 102.942 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.38 63.16 1.33 Allowed 'General case' 0 CA--C 1.563 1.457 0 CA-C-O 122.909 1.338 . . . . 0.0 111.301 -179.346 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -142.01 -50.88 0.4 Allowed 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 125.896 1.679 . . . . 0.0 107.635 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 18.8 ptt? -78.92 29.59 0.21 Allowed 'General case' 0 CA--C 1.583 2.24 0 CA-C-N 119.838 1.199 . . . . 0.0 112.444 176.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.32 3.1 pp -83.16 -61.45 1.85 Allowed 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 125.827 1.651 . . . . 0.0 107.468 177.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -82.98 -37.25 24.29 Favored 'General case' 0 CA--C 1.561 1.402 0 C-N-CA 125.225 1.41 . . . . 0.0 109.641 176.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -63.01 -39.24 94.17 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 116.743 -1.598 . . . . 0.0 111.262 177.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -63.93 -46.76 83.3 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 121.23 1.832 . . . . 0.0 109.981 176.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.317 0.5 OUTLIER -65.26 -9.66 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.482 0 C-N-CA 125.323 1.449 . . . . 0.0 114.748 177.285 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -99.73 -37.37 9.13 Favored 'General case' 0 CA--C 1.577 1.99 0 C-N-CA 128.272 2.629 . . . . 0.0 107.066 176.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -65.5 -41.29 93.4 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 126.632 1.973 . . . . 0.0 115.278 177.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.276 1.8 mp -64.95 -53.52 40.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -61.98 -31.27 71.62 Favored 'General case' 0 CA--C 1.572 1.8 0 CA-C-O 118.093 -0.956 . . . . 0.0 110.897 176.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -67.93 -50.69 54.56 Favored 'General case' 0 CA--C 1.567 1.628 0 CA-C-N 119.875 1.216 . . . . 0.0 111.664 177.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -49.12 -58.04 5.63 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 177.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.265 11.6 pt20 -63.0 -33.31 75.16 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 -179.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -71.88 -28.3 63.43 Favored 'General case' 0 CA--C 1.563 1.456 0 N-CA-C 114.669 1.359 . . . . 0.0 114.669 177.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.1 mt -60.41 -61.34 2.67 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 120.002 1.274 . . . . 0.0 113.77 177.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -73.26 -54.16 9.1 Favored 'General case' 0 CA--C 1.56 1.34 0 C-N-CA 124.612 1.165 . . . . 0.0 113.733 177.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? . . . . . 0 CA--C 1.553 1.095 0 C-N-CA 124.118 0.967 . . . . 0.0 108.775 177.996 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 103.65 -2.722 . . . . 0.0 103.65 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.8 ptt? -142.86 62.9 1.4 Allowed 'General case' 0 CA--C 1.557 1.218 0 CA-C-O 122.903 1.335 . . . . 0.0 111.87 -179.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -149.47 -61.78 0.22 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 105.797 -1.927 . . . . 0.0 105.797 177.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.8 mtt -71.19 17.46 0.08 Allowed 'General case' 0 CA--C 1.576 1.955 0 N-CA-C 115.894 1.813 . . . . 0.0 115.894 177.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 74.4 mt -80.59 -76.96 0.21 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.758 2.023 . . . . 0.0 105.666 177.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -75.58 -33.59 60.6 Favored 'General case' 0 CA--C 1.564 1.512 0 CA-C-O 117.806 -1.092 . . . . 0.0 110.789 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.29 -39.7 92.89 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 116.455 -1.736 . . . . 0.0 111.701 177.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -64.22 -45.96 85.94 Favored 'General case' 0 N--CA 1.501 2.101 0 CA-C-N 121.679 2.036 . . . . 0.0 110.669 176.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -63.48 -17.39 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.589 2.443 0 C-N-CA 125.279 1.432 . . . . 0.0 114.01 177.361 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -90.91 -40.09 11.91 Favored 'General case' 0 CA--C 1.57 1.722 0 C-N-CA 127.283 2.233 . . . . 0.0 107.069 176.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -63.2 -43.94 96.74 Favored 'General case' 0 CA--C 1.561 1.403 0 C-N-CA 126.414 1.886 . . . . 0.0 115.086 177.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.281 1.8 mp -65.93 -52.57 47.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 177.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -60.6 -30.19 69.67 Favored 'General case' 0 CA--C 1.572 1.806 0 CA-C-O 118.44 -0.79 . . . . 0.0 111.693 176.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -70.88 -51.39 26.64 Favored 'General case' 0 CA--C 1.565 1.521 0 CA-C-N 119.37 0.987 . . . . 0.0 111.46 177.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -48.51 -53.1 19.36 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -74.31 -28.39 61.15 Favored 'General case' 0 CA--C 1.566 1.561 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -138.07 68.42 1.4 Allowed 'General case' 0 CA--C 1.567 1.612 0 C-N-CA 124.141 0.977 . . . . 0.0 109.863 177.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 12.8 mt -56.16 -40.05 73.28 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 116.966 2.21 . . . . 0.0 116.966 177.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 49.7 p90 -68.13 176.38 2.72 Favored 'General case' 0 CA--C 1.575 1.905 0 C-N-CA 125.722 1.609 . . . . 0.0 114.11 177.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.3 tttm . . . . . 0 CA--C 1.557 1.228 0 O-C-N 121.001 -1.062 . . . . 0.0 110.688 179.055 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . 0.283 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.797 0 N-CA-C 101.481 -3.525 . . . . 0.0 101.481 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 13.1 mmt 55.8 57.27 5.34 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 115.672 1.731 . . . . 0.0 115.672 177.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . 0.275 13.2 p-10 -160.56 -66.14 0.07 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 177.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 33.1 mtm -72.92 13.87 0.34 Allowed 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 115.864 1.802 . . . . 0.0 115.864 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 84.3 mt -89.76 -69.81 0.7 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.361 2.264 . . . . 0.0 105.353 177.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -67.68 -35.51 78.97 Favored 'General case' 0 CA--C 1.563 1.469 0 C-N-CA 124.014 0.926 . . . . 0.0 111.661 176.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.74 -39.9 80.13 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 116.501 -1.714 . . . . 0.0 109.967 176.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -62.1 -46.79 87.51 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-N 121.542 1.974 . . . . 0.0 110.962 176.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.324 0.5 OUTLIER -62.48 -21.64 27.67 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.381 0 C-N-CA 125.174 1.39 . . . . 0.0 113.687 177.35 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -86.48 -37.84 17.88 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 126.692 1.997 . . . . 0.0 107.623 176.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -64.95 -44.77 88.32 Favored 'General case' 0 CA--C 1.562 1.416 0 C-N-CA 126.418 1.887 . . . . 0.0 114.701 177.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.278 1.8 mp -66.17 -52.2 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 177.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -60.87 -30.06 69.92 Favored 'General case' 0 CA--C 1.572 1.821 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.391 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -68.94 -53.02 23.2 Favored 'General case' 0 CA--C 1.565 1.548 0 CA-C-N 119.725 1.148 . . . . 0.0 110.881 177.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -50.86 -50.78 56.13 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.256 3.9 tp-100 -63.09 -45.5 91.79 Favored 'General case' 0 CA--C 1.564 1.481 0 C-N-CA 126.527 1.931 . . . . 0.0 115.51 177.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -129.93 67.0 1.47 Allowed 'General case' 0 CA--C 1.564 1.513 0 C-N-CA 124.272 1.029 . . . . 0.0 112.0 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 12.0 mt -53.92 -49.63 68.19 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 115.541 1.682 . . . . 0.0 115.541 177.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.9 p90 -87.2 60.14 5.98 Favored 'General case' 0 CA--C 1.57 1.741 0 C-N-CA 126.335 1.854 . . . . 0.0 112.24 177.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.5 tttp . . . . . 0 N--CA 1.483 1.222 0 O-C-N 120.903 -1.123 . . . . 0.0 111.569 -179.806 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 103.937 -2.616 . . . . 0.0 103.937 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.27 55.02 1.76 Allowed 'General case' 0 CA--C 1.558 1.266 0 CA-C-O 122.405 1.098 . . . . 0.0 112.946 -179.271 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -137.82 -59.65 0.65 Allowed 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.5 mtt -71.89 17.14 0.1 Allowed 'General case' 0 CA--C 1.575 1.91 0 N-CA-C 116.094 1.886 . . . . 0.0 116.094 177.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 81.2 mt -83.9 -75.22 0.34 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.76 2.024 . . . . 0.0 105.717 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -72.53 -33.93 67.2 Favored 'General case' 0 CA--C 1.561 1.391 0 CA-C-O 117.955 -1.022 . . . . 0.0 111.07 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -66.73 -39.21 87.89 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 116.502 -1.713 . . . . 0.0 111.216 177.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -63.79 -46.3 85.81 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 121.695 2.043 . . . . 0.0 110.799 176.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.323 0.5 OUTLIER -62.75 -20.22 24.82 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.369 0 C-N-CA 125.154 1.382 . . . . 0.0 113.746 177.292 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -87.82 -38.87 15.33 Favored 'General case' 0 CA--C 1.571 1.769 0 C-N-CA 126.937 2.095 . . . . 0.0 107.347 176.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -64.54 -44.87 89.46 Favored 'General case' 0 CA--C 1.561 1.378 0 C-N-CA 126.351 1.86 . . . . 0.0 114.992 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.279 1.8 mp -65.69 -52.19 53.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 177.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -60.76 -31.72 71.05 Favored 'General case' 0 CA--C 1.571 1.764 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.367 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -69.79 -49.5 52.22 Favored 'General case' 0 CA--C 1.564 1.516 0 CA-C-N 119.737 1.153 . . . . 0.0 111.877 177.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -47.02 -53.92 11.4 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 115.787 1.773 . . . . 0.0 115.787 177.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.25 7.3 pt20 -70.43 -32.9 70.68 Favored 'General case' 0 CA--C 1.56 1.363 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -179.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 29.2 p30 -71.69 -27.45 63.05 Favored 'General case' 0 CA--C 1.562 1.425 0 N-CA-C 116.894 2.183 . . . . 0.0 116.894 177.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.0 mt -55.92 -47.77 76.9 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -85.99 56.33 3.93 Favored 'General case' 0 CA--C 1.57 1.745 0 C-N-CA 125.013 1.325 . . . . 0.0 113.953 178.012 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.6 tttm . . . . . 0 N--CA 1.483 1.193 0 O-C-N 120.871 -1.143 . . . . 0.0 110.89 -179.974 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.134 0 N-CA-C 102.347 -3.205 . . . . 0.0 102.347 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.425 ' O ' ' SD ' ' A' ' 2' ' ' MET . 4.3 ppp? -144.48 51.95 1.26 Allowed 'General case' 0 CA--C 1.557 1.246 0 CA-C-O 122.227 1.013 . . . . 0.0 113.558 -179.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -138.91 -60.05 0.59 Allowed 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.3 mtp -72.1 17.21 0.1 Allowed 'General case' 0 CA--C 1.575 1.908 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 177.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 73.9 mt -81.17 -78.09 0.19 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.673 1.989 . . . . 0.0 106.306 177.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -72.93 -33.78 66.15 Favored 'General case' 0 CA--C 1.563 1.466 0 CA-C-O 117.769 -1.11 . . . . 0.0 110.894 176.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -64.69 -40.66 95.76 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 116.636 -1.65 . . . . 0.0 111.448 177.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -63.86 -46.3 85.61 Favored 'General case' 0 N--CA 1.501 2.121 0 CA-C-N 121.428 1.922 . . . . 0.0 110.785 176.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.322 0.5 OUTLIER -62.83 -19.94 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.587 2.395 0 C-N-CA 125.255 1.422 . . . . 0.0 113.812 177.298 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -88.14 -37.12 16.44 Favored 'General case' 0 CA--C 1.573 1.839 0 C-N-CA 126.91 2.084 . . . . 0.0 107.508 176.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -65.6 -44.87 85.28 Favored 'General case' 0 CA--C 1.563 1.477 0 C-N-CA 126.428 1.891 . . . . 0.0 114.387 177.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.274 1.8 mp -66.1 -51.71 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -60.22 -31.89 70.6 Favored 'General case' 0 CA--C 1.57 1.749 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.123 176.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -67.39 -51.63 49.56 Favored 'General case' 0 CA--C 1.567 1.62 0 CA-C-N 119.799 1.182 . . . . 0.0 111.762 177.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -48.89 -58.9 4.11 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.251 7.4 pt20 -62.68 -33.99 76.21 Favored 'General case' 0 CA--C 1.558 1.265 0 N-CA-C 117.076 2.25 . . . . 0.0 117.076 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -71.59 -27.89 63.44 Favored 'General case' 0 CA--C 1.561 1.393 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.0 mt -62.14 -62.06 2.04 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 120.114 1.324 . . . . 0.0 113.695 177.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -72.42 -55.15 7.5 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 124.605 1.162 . . . . 0.0 113.897 177.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 84.5 tttt . . . . . 0 CA--C 1.554 1.097 0 C-N-CA 124.121 0.969 . . . . 0.0 109.439 178.722 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 102.623 -3.103 . . . . 0.0 102.623 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.09 66.34 1.2 Allowed 'General case' 0 CA--C 1.564 1.491 0 CA-C-O 123.243 1.497 . . . . 0.0 111.084 -179.363 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 15.1 t30 -153.04 -54.07 0.11 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 125.863 1.665 . . . . 0.0 106.801 177.781 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 30.4 mtp -75.81 26.98 0.11 Allowed 'General case' 0 CA--C 1.583 2.22 0 CA-C-N 119.711 1.141 . . . . 0.0 113.002 176.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.312 2.8 pp -80.75 -61.51 1.95 Allowed 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 125.935 1.694 . . . . 0.0 107.906 177.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -86.67 -37.5 17.94 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.578 1.551 . . . . 0.0 109.5 176.925 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -63.0 -38.58 91.77 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-O 116.782 -1.58 . . . . 0.0 111.973 177.313 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -65.75 -46.15 79.94 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 121.339 1.881 . . . . 0.0 110.328 176.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . 0.319 0.5 OUTLIER -64.06 -16.35 18.68 Favored 'Isoleucine or valine' 0 CA--C 1.588 2.424 0 C-N-CA 125.201 1.4 . . . . 0.0 113.757 177.193 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -91.27 -39.11 12.26 Favored 'General case' 0 CA--C 1.571 1.782 0 C-N-CA 127.452 2.301 . . . . 0.0 107.24 176.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -65.01 -47.91 75.8 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 126.406 1.882 . . . . 0.0 115.187 177.636 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . 0.267 1.8 mp -65.93 -51.3 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 177.534 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -60.14 -32.64 71.21 Favored 'General case' 0 CA--C 1.567 1.634 0 CA-C-O 117.612 -1.185 . . . . 0.0 111.252 176.512 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -68.14 -52.16 37.84 Favored 'General case' 0 CA--C 1.567 1.607 0 CA-C-N 120.152 1.342 . . . . 0.0 111.679 177.214 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -46.76 -50.78 17.63 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 116.206 1.928 . . . . 0.0 116.206 177.795 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . 0.271 12.2 pt20 -71.59 -36.28 70.81 Favored 'General case' 0 CA--C 1.559 1.313 0 N-CA-C 116.432 2.012 . . . . 0.0 116.432 -179.541 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.0 -19.4 63.33 Favored 'General case' 0 CA--C 1.567 1.598 0 N-CA-C 116.842 2.164 . . . . 0.0 116.842 177.703 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 23.2 mt -77.01 75.45 3.58 Favored 'General case' 0 CA--C 1.568 1.661 0 C-N-CA 124.428 1.091 . . . . 0.0 112.408 -179.938 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -85.45 -69.16 0.68 Allowed 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.436 -0.79 . . . . 0.0 113.025 -179.672 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 7.9 tmtm? . . . . . 0 N--CA 1.485 1.277 0 C-N-CA 123.792 0.837 . . . . 0.0 112.064 -179.902 . . . . . . . . 0 0 . 1 stop_ save_