data_2mar_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 2mar _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 ' 5' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo . . . . . 0 CA--C 1.548 1.176 0 CA-C-O 119.032 -0.487 . . . . 0.0 112.043 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -73.7 -19.08 21.65 Favored 'Trans proline' 0 CA--C 1.554 1.493 0 C-N-CA 122.438 2.092 . . . . 0.0 116.604 165.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.78 168.39 23.91 Favored 'Trans proline' 0 C--N 1.362 1.24 0 CA-C-N 124.462 2.629 . . . . 0.0 112.353 176.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -60.44 127.96 24.51 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.673 2.249 . . . . 0.0 111.181 170.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -51.88 -41.71 62.12 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.522 0.677 . . . . 0.0 111.747 168.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -95.86 41.87 1.1 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 128.62 2.768 . . . . 0.0 112.954 176.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.6 112.68 0.58 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.873 1.269 . . . . 0.0 113.039 174.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.15 -16.45 2.12 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 126.128 1.823 . . . . 0.0 114.236 -177.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.05 160.42 78.37 Favored Pre-proline 0 CA--C 1.558 1.274 0 C-N-CA 125.535 1.534 . . . . 0.0 113.866 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -75.71 171.34 18.38 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.899 3.066 . . . . 0.0 113.545 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -53.86 -36.62 62.82 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.463 1.105 . . . . 0.0 113.785 -176.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -53.4 -42.34 66.87 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.711 1.604 . . . . 0.0 112.551 173.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 77.8 t -77.47 -41.55 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 124.649 1.18 . . . . 0.0 111.673 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.3 t -55.24 -37.81 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 118.641 0.655 . . . . 0.0 111.583 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.0 tptm -62.48 -50.67 70.49 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.245 -0.909 . . . . 0.0 111.865 172.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.49 -46.51 80.43 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.003 0.82 . . . . 0.0 112.515 176.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -53.84 49.17 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.775 0.83 . . . . 0.0 111.527 172.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -64.03 -44.93 91.05 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.521 1.055 . . . . 0.0 113.209 -178.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.42 -37.97 82.57 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.248 1.019 . . . . 0.0 111.589 177.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.6 tp -66.7 -46.02 76.92 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 122.966 0.506 . . . . 0.0 111.259 169.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.63 -42.53 95.41 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -178.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.36 -29.34 61.29 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.993 1.27 . . . . 0.0 113.361 177.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.7 tttp -72.67 -33.95 66.89 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.686 1.195 . . . . 0.0 112.989 175.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . 0.285 15.9 p30 -109.78 22.1 16.09 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.983 1.313 . . . . 0.0 113.934 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -58.72 -24.54 61.66 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.05 -1.656 . . . . 0.0 113.178 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 31.9 p -96.87 -0.89 47.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 127.522 2.329 . . . . 0.0 114.388 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -77.87 179.72 6.54 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.876 1.671 . . . . 0.0 112.969 173.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.86 171.5 9.56 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.378 2.271 . . . . 0.0 112.503 173.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -59.13 8.76 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 125.413 1.485 . . . . 0.0 112.556 175.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -66.43 -28.41 46.27 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 122.254 1.97 . . . . 0.0 113.65 -178.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -72.71 -39.89 66.6 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.439 -0.788 . . . . 0.0 111.669 -176.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 52.7 mt -70.52 -53.04 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.669 1.188 . . . . 0.0 110.21 171.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -57.97 -36.83 73.14 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 118.39 -0.814 . . . . 0.0 112.051 -176.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -52.79 -57.28 10.7 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.078 1.351 . . . . 0.0 111.77 172.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.38 -41.37 96.99 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.5 0.72 . . . . 0.0 111.691 -177.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.45 -47.45 85.67 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.001 0.92 . . . . 0.0 111.384 174.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -62.46 -38.6 90.43 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.323 1.049 . . . . 0.0 113.105 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.33 -49.93 68.58 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.405 -0.809 . . . . 0.0 112.578 179.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 7.6 p-90 -73.73 -33.93 64.54 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 172.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.44 -30.39 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 125.074 1.35 . . . . 0.0 112.82 174.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.83 -16.66 18.23 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 118.836 0.743 . . . . 0.0 112.875 176.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.44 -16.21 21.32 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.189 1.396 . . . . 0.0 113.902 173.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 40.2 mt . . . . . 0 N--CA 1.474 0.75 0 CA-C-N 119.024 0.829 . . . . 0.0 112.629 175.571 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 N--CA 1.476 0.846 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -61.5 -53.32 57.92 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 124.375 1.07 . . . . 0.0 112.156 177.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt -56.08 -35.6 67.16 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.574 0.749 . . . . 0.0 111.661 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.72 -50.57 34.85 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.838 0.855 . . . . 0.0 111.48 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.8 tttt -58.83 -49.71 76.7 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.554 0.742 . . . . 0.0 110.688 176.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -62.31 -49.16 76.74 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.636 0.774 . . . . 0.0 111.954 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.01 -44.55 94.5 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.006 0.821 . . . . 0.0 111.9 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -66.72 -46.27 76.03 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.601 0.761 . . . . 0.0 112.224 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.8 tt -54.93 -51.13 67.06 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.804 0.842 . . . . 0.0 111.166 169.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.52 -40.09 96.13 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 118.553 -0.736 . . . . 0.0 112.176 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -57.77 -50.92 71.63 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.724 1.21 . . . . 0.0 111.929 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.15 -48.56 73.13 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.314 0.646 . . . . 0.0 112.156 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -59.33 -48.91 79.83 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.161 0.984 . . . . 0.0 110.708 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -55.65 -46.36 77.48 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.763 1.225 . . . . 0.0 113.039 173.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -51.69 65.69 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.174 0.897 . . . . 0.0 111.772 176.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.43 -32.93 74.81 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 175.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 48.8 t -72.69 -25.42 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 125.312 1.445 . . . . 0.0 113.139 178.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.85 -29.63 67.1 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.1 ptmt -89.24 -3.19 58.64 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.863 1.665 . . . . 0.0 114.16 172.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.7 tpp -94.74 -163.54 1.06 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.339 1.856 . . . . 0.0 112.018 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -52.64 152.18 7.02 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 126.94 2.096 . . . . 0.0 114.118 172.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -72.52 -39.11 2.89 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.697 2.932 . . . . 0.0 113.876 -174.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -62.86 -33.04 74.44 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.102 -0.999 . . . . 0.0 112.437 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.26 -44.06 92.93 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.902 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.04 -42.63 65.92 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.098 1.359 . . . . 0.0 112.634 173.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.3 mmtm -65.5 -52.62 51.42 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.279 1.432 . . . . 0.0 111.681 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.87 -53.16 60.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.501 0.72 . . . . 0.0 112.16 173.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.31 -36.0 82.69 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.11 -48.48 81.53 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.133 0.879 . . . . 0.0 111.216 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -56.64 -49.58 74.6 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 171.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.2 mt -60.7 -35.17 75.62 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.543 0.737 . . . . 0.0 112.296 178.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.4 t -73.05 -46.55 51.11 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.678 1.191 . . . . 0.0 113.043 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -65.97 -43.03 89.05 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.514 -0.741 . . . . 0.0 110.89 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.1 tt -68.95 -34.62 65.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.88 -18.06 63.81 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 . . . . . 0 N--CA 1.474 0.753 0 C-N-CA 124.282 1.033 . . . . 0.0 113.732 169.592 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -48.72 -38.06 20.49 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.218 -0.926 . . . . 0.0 112.554 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -58.93 -59.33 5.63 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.289 0.636 . . . . 0.0 111.225 173.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.64 -35.37 80.79 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.934 0.788 . . . . 0.0 112.623 -176.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 9.0 tm0? -59.09 -46.25 88.77 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.926 0.89 . . . . 0.0 111.554 171.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -50.35 74.03 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.396 -0.812 . . . . 0.0 111.494 173.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 31.0 mm -51.11 -50.84 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 124.793 1.237 . . . . 0.0 110.797 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -64.03 -45.99 86.45 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.604 0.638 . . . . 0.0 112.053 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.15 -44.78 83.75 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.501 0.72 . . . . 0.0 111.8 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 28.0 pt -71.54 -41.11 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-O 118.746 -0.645 . . . . 0.0 112.556 173.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 90.5 t80 . . . . . 0 N--CA 1.474 0.757 0 CA-C-N 120.362 1.437 . . . . 0.0 112.857 -178.329 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 CA--C 1.536 0.609 0 CA-C-O 121.735 0.639 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -63.2 -23.39 67.41 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.317 -0.865 . . . . 0.0 112.791 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.3 m -62.44 -51.7 66.48 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.318 0.963 . . . . 0.0 112.118 176.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 10.8 p -72.23 -39.96 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 118.249 0.477 . . . . 0.0 111.414 178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.82 -46.42 84.73 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.779 173.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -69.18 -40.27 78.19 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.605 1.093 . . . . 0.0 113.438 177.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -68.65 -31.28 70.31 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 121.039 -1.038 . . . . 0.0 113.055 177.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -93.34 -16.95 24.11 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.447 1.099 . . . . 0.0 113.594 178.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 N--CA 1.476 0.842 0 C-N-CA 124.939 1.296 . . . . 0.0 112.367 174.945 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo . . . . . 0 CA--C 1.543 0.927 0 CA-C-O 119.29 -0.379 . . . . 0.0 111.648 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.81 -25.29 39.54 Favored 'Trans proline' 0 CA--C 1.551 1.368 0 C-N-CA 122.442 2.095 . . . . 0.0 116.367 167.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.4 163.87 34.85 Favored 'Trans proline' 0 C--N 1.362 1.254 0 CA-C-N 124.116 2.506 . . . . 0.0 112.754 176.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 36.8 Cg_endo -61.4 133.81 48.17 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.9 2.4 . . . . 0.0 111.34 171.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -49.9 -43.67 49.67 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.335 0.654 . . . . 0.0 111.669 169.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -83.06 18.91 1.53 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.216 1.807 . . . . 0.0 115.102 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.36 105.59 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.625 1.97 . . . . 0.0 115.24 -173.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.28 26.68 0.2 Allowed Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.757 1.17 . . . . 0.0 114.661 -172.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -120.97 156.85 56.33 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 126.198 1.799 . . . . 0.0 112.01 -174.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -73.45 166.39 29.98 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 123.394 2.73 . . . . 0.0 113.239 -178.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -52.46 -41.02 62.96 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.512 1.525 . . . . 0.0 113.133 -179.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -55.36 -39.54 70.18 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.883 1.673 . . . . 0.0 113.027 175.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 74.8 t -80.35 -40.33 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 124.881 1.273 . . . . 0.0 111.705 175.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.1 t -55.9 -39.81 58.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.876 0.87 . . . . 0.0 110.987 177.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -59.72 -50.66 72.96 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 121.002 -1.061 . . . . 0.0 112.178 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.57 -47.02 83.23 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.852 0.861 . . . . 0.0 111.818 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.429 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.9 OUTLIER -51.96 -50.09 61.93 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.498 1.119 . . . . 0.0 111.861 168.182 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -44.82 95.52 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.225 0.92 . . . . 0.0 113.038 -178.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -65.85 -34.86 79.13 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.546 -0.721 . . . . 0.0 111.789 176.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 tp -66.64 -41.05 88.87 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 171.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -72.23 -25.56 61.68 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.5 mmtt -53.62 -46.76 70.55 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.583 1.083 . . . . 0.0 113.051 175.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.0 ptmt -70.06 -24.77 63.3 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 173.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -104.21 17.56 23.88 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 126.761 2.025 . . . . 0.0 113.008 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.68 -19.07 65.52 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.185 -1.572 . . . . 0.0 113.175 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.2 p -98.6 3.41 47.96 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.871 2.469 . . . . 0.0 114.206 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -73.37 179.61 3.89 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.426 1.49 . . . . 0.0 112.802 173.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -117.65 172.49 7.32 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 127.513 2.325 . . . . 0.0 111.227 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.7 -57.62 6.53 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 126.544 1.938 . . . . 0.0 112.826 176.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -69.73 -37.33 9.38 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.349 2.033 . . . . 0.0 113.426 177.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -64.79 -41.57 95.72 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 120.788 -1.195 . . . . 0.0 112.269 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 56.8 mt -67.14 -53.29 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-O 118.431 -0.795 . . . . 0.0 109.428 174.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -57.39 -41.04 79.5 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.555 1.071 . . . . 0.0 112.187 -175.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.433 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 6.5 mmpt? -57.14 -60.79 3.08 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.3 1.44 . . . . 0.0 112.806 174.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.14 -33.96 77.27 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -174.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.93 -50.14 63.31 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 124.649 1.179 . . . . 0.0 111.235 173.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -55.28 -39.42 69.84 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.983 0.81 . . . . 0.0 112.912 175.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.36 -50.23 67.97 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 8.4 p-90 -73.8 -34.5 64.64 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 169.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -56.56 -32.19 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 125.194 1.397 . . . . 0.0 112.193 174.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.28 -19.27 44.74 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 118.935 0.789 . . . . 0.0 112.686 177.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 48.9 m -89.95 -24.49 21.28 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.983 1.313 . . . . 0.0 112.898 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 37.5 mt . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -179.937 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 13.3 mmt -64.27 -50.02 69.57 Favored 'General case' 0 N--CA 1.462 0.169 0 C-N-CA 123.032 0.533 . . . . 0.0 112.174 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -57.38 -35.02 69.46 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.292 0.637 . . . . 0.0 112.197 175.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.83 -51.5 22.14 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.236 1.014 . . . . 0.0 111.805 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -50.98 70.79 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.758 0.823 . . . . 0.0 110.599 174.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -60.88 -50.43 73.47 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.213 0.605 . . . . 0.0 111.99 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.13 92.95 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.803 0.728 . . . . 0.0 112.65 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -64.02 -50.33 68.9 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.772 0.829 . . . . 0.0 112.088 176.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 42.2 mt -55.66 -51.07 68.48 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.417 1.087 . . . . 0.0 110.724 175.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.37 -51.35 65.09 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.118 0.967 . . . . 0.0 113.108 172.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -53.16 -50.74 63.97 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 120.218 1.372 . . . . 0.0 112.268 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.29 -48.85 74.1 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.424 0.689 . . . . 0.0 112.35 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -55.57 -52.88 62.27 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 123.804 0.842 . . . . 0.0 110.88 174.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -52.08 -46.96 65.4 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.997 2.119 . . . . 0.0 112.295 177.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -48.55 78.1 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.848 0.859 . . . . 0.0 112.26 174.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.63 -33.88 76.63 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 173.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 92.6 t -69.98 -28.14 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 125.293 1.437 . . . . 0.0 111.925 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.04 -20.2 37.28 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 176.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.91 1.31 26.6 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 126.299 1.84 . . . . 0.0 114.173 173.28 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 tpp -98.64 -161.59 0.89 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.701 2.001 . . . . 0.0 112.025 -175.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.1 156.5 20.1 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 125.507 1.523 . . . . 0.0 113.942 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.56 -42.55 2.5 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.728 2.952 . . . . 0.0 113.345 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.64 -36.55 83.18 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.899 1.28 . . . . 0.0 112.571 177.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.62 -40.99 89.38 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.756 175.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -56.12 -45.72 79.42 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 117.852 -1.07 . . . . 0.0 112.368 176.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.31 -53.73 50.87 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.375 1.47 . . . . 0.0 111.369 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.63 -55.05 36.66 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.653 0.781 . . . . 0.0 111.885 176.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.25 -32.35 71.5 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -176.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.92 -46.38 89.61 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.023 -1.048 . . . . 0.0 111.856 170.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -58.53 -50.42 73.82 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.445 0.698 . . . . 0.0 111.977 171.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.2 mp -57.83 -34.58 69.83 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.646 0.657 . . . . 0.0 111.833 174.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.5 t -69.82 -50.83 39.01 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.012 -1.055 . . . . 0.0 112.657 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? -64.71 -40.2 94.94 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 118.677 -0.678 . . . . 0.0 110.898 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.5 tp -70.37 -37.15 69.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 119.224 0.92 . . . . 0.0 111.824 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.93 -21.0 65.13 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -176.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.711 0 C-N-CA 124.903 1.281 . . . . 0.0 113.634 174.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -41.3 -46.43 3.23 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.906 1.682 . . . . 0.0 113.025 170.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -59.67 -59.13 5.92 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.615 0.766 . . . . 0.0 111.617 176.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.23 -35.62 80.9 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.671 0.789 . . . . 0.0 112.833 -175.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -53.86 -50.9 65.25 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 124.784 1.233 . . . . 0.0 110.779 167.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.4 tttt -57.29 -49.2 76.84 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.424 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 9.9 mm -54.74 -48.67 72.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.898 0.879 . . . . 0.0 111.758 176.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -64.5 -45.12 88.65 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.296 0.953 . . . . 0.0 112.844 177.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.51 -48.92 79.79 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.433 1.093 . . . . 0.0 111.822 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -68.88 -38.41 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.061 0.544 . . . . 0.0 112.142 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 63.0 t80 . . . . . 0 N--CA 1.472 0.625 0 CA-C-N 119.61 1.095 . . . . 0.0 113.016 177.418 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo . . . . . 0 N--CA 1.458 -0.585 0 N-CA-C 110.45 -0.634 . . . . 0.0 110.45 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -55.05 -30.46 59.63 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.596 -0.69 . . . . 0.0 111.818 176.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 46.7 p -56.69 -50.73 71.26 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.066 1.746 . . . . 0.0 113.202 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.94 -41.79 94.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 CA-C-N 119.619 1.099 . . . . 0.0 110.507 177.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -62.55 -46.27 89.15 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.356 177.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.52 -37.86 87.97 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.978 1.263 . . . . 0.0 113.244 176.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.74 -37.43 73.46 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.271 -0.893 . . . . 0.0 112.531 177.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -87.02 -19.11 29.14 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.445 1.098 . . . . 0.0 113.272 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.475 0.817 0 C-N-CA 125.789 1.636 . . . . 0.0 112.131 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo . . . . . 0 CA--C 1.544 0.999 0 N-CA-C 110.772 -0.511 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -68.19 -22.54 40.49 Favored 'Trans proline' 0 CA--C 1.552 1.383 0 C-N-CA 122.341 2.027 . . . . 0.0 116.281 167.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -69.89 167.95 23.13 Favored 'Trans proline' 0 C--N 1.362 1.274 0 CA-C-N 124.531 2.654 . . . . 0.0 113.828 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.425 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 36.7 Cg_endo -61.21 119.74 7.05 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 123.629 2.886 . . . . 0.0 111.772 173.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -54.0 -27.87 34.47 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 172.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -108.08 35.34 3.18 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 128.122 2.569 . . . . 0.0 112.693 178.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -41.93 112.46 0.33 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.475 1.51 . . . . 0.0 114.044 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 151.42 -17.66 0.89 Allowed Glycine 0 CA--C 1.539 1.553 0 C-N-CA 126.588 2.042 . . . . 0.0 113.929 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.14 159.25 65.65 Favored Pre-proline 0 CA--C 1.553 1.089 0 C-N-CA 125.598 1.559 . . . . 0.0 113.919 -175.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.66 172.19 16.71 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.643 2.895 . . . . 0.0 113.27 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -53.65 -34.07 57.37 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.549 1.139 . . . . 0.0 113.438 -179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.62 -36.08 71.31 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.503 1.521 . . . . 0.0 112.65 175.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 43.3 t -79.14 -43.02 24.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 125.113 1.365 . . . . 0.0 111.553 170.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 86.0 t -53.36 -37.9 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 119.035 0.834 . . . . 0.0 111.642 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tppt? -61.14 -51.1 70.49 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.001 -1.062 . . . . 0.0 112.402 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.12 -49.48 76.83 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.668 0.787 . . . . 0.0 111.283 176.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.425 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -51.06 -52.34 44.29 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.33 1.052 . . . . 0.0 111.827 171.655 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -61.41 -45.47 94.2 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.89 1.223 . . . . 0.0 113.226 -178.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -69.83 -26.42 64.22 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 122.949 0.5 . . . . 0.0 112.282 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -72.84 -54.15 9.56 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.005 0.922 . . . . 0.0 111.903 168.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.22 -43.12 82.54 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.704 1.602 . . . . 0.0 114.131 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.91 -27.11 64.94 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.508 1.049 . . . . 0.0 112.942 175.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -38.08 66.94 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.966 1.706 . . . . 0.0 112.501 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.98 19.47 19.53 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.08 2.152 . . . . 0.0 113.99 177.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -59.23 -23.54 62.4 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 119.595 -1.941 . . . . 0.0 113.418 -176.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.2 p -82.14 2.13 32.94 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 128.929 2.892 . . . . 0.0 115.072 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -93.08 -176.06 4.05 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 126.548 1.939 . . . . 0.0 112.417 173.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.45 167.15 11.17 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.31 2.244 . . . . 0.0 111.745 174.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -43.5 -59.8 3.06 Favored Pre-proline 0 N--CA 1.473 0.705 0 C-N-CA 125.704 1.602 . . . . 0.0 113.313 174.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -66.75 -35.82 26.54 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 121.827 1.684 . . . . 0.0 113.642 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.42 -50.77 71.48 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.686 1.194 . . . . 0.0 111.324 -177.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 10.4 mt -66.94 -48.43 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.3 1.04 . . . . 0.0 112.379 172.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -49.49 -46.07 47.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.643 0.777 . . . . 0.0 110.574 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -52.04 -47.78 64.88 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.508 1.049 . . . . 0.0 113.328 174.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -63.13 -49.16 75.47 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.286 1.034 . . . . 0.0 111.79 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.75 -48.93 79.52 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.975 0.91 . . . . 0.0 110.433 176.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -58.54 -35.29 72.09 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 125.008 1.323 . . . . 0.0 114.297 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.15 -53.49 57.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.553 0.615 . . . . 0.0 112.437 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -73.29 -29.75 62.93 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 113.18 0.808 . . . . 0.0 113.18 175.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.22 -33.51 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.301 1.84 . . . . 0.0 113.588 172.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -56.71 -15.24 4.19 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 119.115 0.87 . . . . 0.0 112.818 173.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.18 -6.7 16.28 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.587 1.555 . . . . 0.0 114.147 176.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.6 mt . . . . . 0 N--CA 1.478 0.934 0 CA-C-N 119.671 1.123 . . . . 0.0 113.415 177.508 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 . . . . . 0 N--CA 1.475 0.805 0 CA-C-O 120.98 0.419 . . . . 0.0 112.066 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -61.97 -52.8 62.55 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.878 1.271 . . . . 0.0 112.335 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -54.74 -34.65 62.78 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.819 -0.61 . . . . 0.0 112.505 174.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.71 -51.96 24.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.97 0.805 . . . . 0.0 111.933 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -58.84 -47.45 84.81 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.37 0.668 . . . . 0.0 111.482 177.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -60.73 -50.95 71.4 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.739 1.216 . . . . 0.0 112.08 176.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.79 -49.61 74.83 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.773 1.169 . . . . 0.0 112.915 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -62.37 -50.67 70.65 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.878 0.871 . . . . 0.0 112.201 178.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tp -56.04 -50.3 71.33 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.662 0.785 . . . . 0.0 111.156 175.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.88 -45.75 85.9 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.347 1.059 . . . . 0.0 111.915 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.5 tptt -57.48 -48.42 79.25 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.564 1.075 . . . . 0.0 112.425 176.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.84 78.44 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.455 0.702 . . . . 0.0 112.254 176.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.39 -50.0 75.25 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.737 1.215 . . . . 0.0 110.878 178.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -51.96 -49.47 63.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 126.382 1.873 . . . . 0.0 112.401 172.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -56.18 -49.08 75.02 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.687 0.795 . . . . 0.0 111.97 178.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.9 -33.41 75.53 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 174.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 56.0 t -69.51 -27.54 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.814 1.246 . . . . 0.0 112.679 178.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.16 -28.73 42.19 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 175.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -98.63 -1.76 40.07 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.973 1.709 . . . . 0.0 114.463 175.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -90.24 -84.68 0.23 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.421 1.088 . . . . 0.0 111.251 175.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -129.97 154.21 81.14 Favored Pre-proline 0 N--CA 1.479 1.02 0 C-N-CA 126.508 1.923 . . . . 0.0 112.991 -173.488 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -69.93 -48.31 0.71 Allowed 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 123.683 2.922 . . . . 0.0 112.611 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -72.66 -33.72 66.75 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.88 -41.55 82.77 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 119.024 -0.513 . . . . 0.0 110.323 174.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.66 -48.98 74.13 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 117.87 -1.062 . . . . 0.0 110.302 173.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -56.38 -54.03 50.36 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.22 0.918 . . . . 0.0 110.736 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.08 -50.82 72.62 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.364 -0.835 . . . . 0.0 113.247 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -67.46 -44.16 79.3 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.815 0.846 . . . . 0.0 112.589 -177.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.86 93.77 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.441 1.097 . . . . 0.0 111.912 173.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.99 -44.02 94.79 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.163 0.585 . . . . 0.0 111.73 174.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -63.47 -35.05 79.17 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 172.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.3 t -69.6 -47.24 64.17 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.43 1.092 . . . . 0.0 112.485 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? -67.95 -41.58 82.25 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.615 0.766 . . . . 0.0 111.157 177.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 7.2 tt -71.07 -32.91 49.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 118.986 0.812 . . . . 0.0 112.6 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.64 -30.36 68.67 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.697 0 C-N-CA 124.755 1.222 . . . . 0.0 113.69 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.478 0.927 0 CA-C-O 121.432 0.634 . . . . 0.0 112.578 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -31.5 4.42 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.344 1.458 . . . . 0.0 114.078 173.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -62.15 -59.81 4.52 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.115 171.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -62.33 -35.13 78.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.394 0.997 . . . . 0.0 112.269 -177.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -59.11 -49.45 77.84 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.616 0.766 . . . . 0.0 112.416 172.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.59 -51.84 67.12 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 117.786 -1.102 . . . . 0.0 110.993 172.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 31.3 mm -49.72 -49.91 19.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.619 1.168 . . . . 0.0 111.355 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -62.09 -52.18 64.93 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.693 0.679 . . . . 0.0 111.856 176.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.1 -33.77 71.23 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.9 pt -79.33 -39.76 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 118.161 -0.923 . . . . 0.0 112.069 169.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 93.7 t80 . . . . . 0 N--CA 1.475 0.809 0 CA-C-N 121.308 1.867 . . . . 0.0 113.837 179.401 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo . . . . . 0 CA--C 1.539 0.752 0 CA-C-O 122.243 0.851 . . . . 0.0 112.734 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -59.16 -26.87 65.13 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 173.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 23.5 p -65.59 -50.08 66.41 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 120.027 1.285 . . . . 0.0 112.833 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.4 p -69.06 -39.3 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.42 0.688 . . . . 0.0 111.551 175.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 10.0 mtpt -59.13 -47.05 86.69 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 118.254 -0.879 . . . . 0.0 112.372 171.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -65.98 -41.28 91.35 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 119.971 1.26 . . . . 0.0 112.786 177.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.08 -37.06 80.8 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.986 -1.072 . . . . 0.0 112.835 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.44 -19.13 31.77 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.474 1.109 . . . . 0.0 113.309 178.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 . . . . . 0 N--CA 1.478 0.958 0 C-N-CA 126.492 1.917 . . . . 0.0 113.922 179.729 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo . . . . . 0 CA--C 1.542 0.909 0 CA-C-O 119.338 -0.359 . . . . 0.0 111.578 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -67.21 -26.01 42.56 Favored 'Trans proline' 0 CA--C 1.55 1.321 0 C-N-CA 122.367 2.045 . . . . 0.0 115.928 167.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.66 162.9 39.13 Favored 'Trans proline' 0 C--N 1.362 1.245 0 CA-C-N 123.954 2.448 . . . . 0.0 112.834 177.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.43 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 34.6 Cg_endo -62.12 140.72 85.46 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.066 2.51 . . . . 0.0 111.827 171.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -52.32 -42.09 63.55 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.634 0.73 . . . . 0.0 112.221 171.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -84.76 19.22 2.11 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.604 1.962 . . . . 0.0 114.873 179.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -34.49 101.5 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.411 2.285 . . . . 0.0 115.548 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.64 29.1 0.14 Allowed Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.058 0.837 . . . . 0.0 114.498 -171.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.04 156.93 59.17 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 125.264 1.426 . . . . 0.0 111.692 -176.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -73.01 169.5 22.05 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.3 2.666 . . . . 0.0 112.777 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -54.12 -38.89 65.92 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.455 1.102 . . . . 0.0 113.423 -177.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.88 -39.24 68.5 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.523 1.529 . . . . 0.0 112.65 174.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.4 t -81.49 -39.63 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 124.899 1.28 . . . . 0.0 111.662 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 49.1 t -55.22 -40.95 58.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.881 0.872 . . . . 0.0 110.847 176.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -60.45 -50.66 72.68 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.929 -1.107 . . . . 0.0 112.378 175.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.24 -48.0 77.36 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.822 0.849 . . . . 0.0 111.855 177.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.43 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.6 OUTLIER -51.54 -50.73 59.46 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.094 0.958 . . . . 0.0 112.025 169.609 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.51 -47.38 86.4 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.968 0.804 . . . . 0.0 112.362 -177.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -66.48 -32.37 73.69 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.321 0.648 . . . . 0.0 112.096 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.6 tp -66.53 -49.08 67.67 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.563 0.745 . . . . 0.0 112.109 169.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.25 -25.13 68.18 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.526 1.53 . . . . 0.0 114.496 177.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -53.17 -33.11 51.16 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 119.888 1.222 . . . . 0.0 113.734 173.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.47 -38.81 65.31 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.296 1.038 . . . . 0.0 112.955 169.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -97.49 19.44 13.36 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.02 1.328 . . . . 0.0 113.096 -175.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.06 -19.83 63.33 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.323 -1.486 . . . . 0.0 114.395 -176.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.28 8.02 21.3 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 126.322 1.849 . . . . 0.0 113.002 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.5 mptt -75.8 178.97 5.76 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 120.638 -1.289 . . . . 0.0 111.658 176.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.09 171.27 7.47 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.441 1.897 . . . . 0.0 111.011 176.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -45.97 -59.08 5.19 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.825 1.65 . . . . 0.0 112.785 174.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.42 -38.57 19.46 Favored 'Trans proline' 0 C--N 1.357 1.016 0 C-N-CA 122.312 2.008 . . . . 0.0 112.613 178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.26 -41.87 97.66 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.121 -0.987 . . . . 0.0 112.117 -177.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 12.1 mt -69.43 -51.45 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.103 0.961 . . . . 0.0 110.213 171.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -51.0 -38.08 49.03 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.05 0.841 . . . . 0.0 112.502 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.01 -60.3 3.64 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.383 1.473 . . . . 0.0 111.643 -179.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -64.08 -37.4 87.3 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.216 0.606 . . . . 0.0 112.19 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -64.68 -50.61 66.36 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.641 0.776 . . . . 0.0 110.93 174.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -56.85 -37.97 72.04 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 118.949 0.795 . . . . 0.0 113.014 176.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.07 -50.8 65.95 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -178.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 9.4 p-90 -73.53 -36.38 65.69 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 170.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -56.89 -32.88 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.086 1.354 . . . . 0.0 112.118 175.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -59.73 -16.39 26.99 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.663 0.785 . . . . 0.0 112.538 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.8 m -102.01 -15.9 16.64 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.172 1.389 . . . . 0.0 112.607 177.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 15.2 mt . . . . . 0 N--CA 1.473 0.703 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 177.516 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.4 -52.36 58.6 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.572 1.549 . . . . 0.0 113.141 176.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -55.07 -34.83 63.94 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 118.585 -0.722 . . . . 0.0 112.143 173.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.27 -51.61 29.2 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.067 0.849 . . . . 0.0 111.778 178.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -58.62 -49.32 77.91 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.899 0.879 . . . . 0.0 111.469 176.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -64.3 -50.03 69.45 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.609 1.163 . . . . 0.0 112.2 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.03 -44.48 91.75 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.177 0.898 . . . . 0.0 111.87 176.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -65.07 -50.42 66.23 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.465 0.706 . . . . 0.0 111.882 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -53.72 -51.2 64.06 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.438 1.095 . . . . 0.0 110.557 172.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.05 -41.04 95.84 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.802 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.86 -50.65 72.96 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.338 1.055 . . . . 0.0 111.999 176.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.42 -47.76 84.28 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.754 0.822 . . . . 0.0 112.635 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -59.68 -51.14 71.06 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.944 0.897 . . . . 0.0 110.687 177.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -46.71 68.14 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.401 1.88 . . . . 0.0 112.968 174.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -54.79 -52.57 62.21 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.187 0.995 . . . . 0.0 112.388 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.99 -30.45 69.71 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 177.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 73.8 t -72.97 -22.57 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.808 1.643 . . . . 0.0 113.153 176.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.65 -30.53 63.44 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 176.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -87.53 0.17 55.96 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.295 1.438 . . . . 0.0 114.554 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.9 tpp -97.09 -162.12 0.93 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.193 1.797 . . . . 0.0 111.844 -177.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -53.41 154.85 5.7 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 126.768 2.027 . . . . 0.0 113.546 171.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -70.13 -43.99 2.06 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.389 2.726 . . . . 0.0 112.41 -177.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -62.45 -28.09 69.57 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.018 0.927 . . . . 0.0 113.26 176.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.33 -48.61 79.05 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.877 -0.514 . . . . 0.0 110.981 177.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.34 -41.26 60.45 Favored 'General case' 0 N--CA 1.482 1.158 0 O-C-N 121.492 -0.755 . . . . 0.0 111.678 173.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -61.75 -50.32 72.87 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.484 1.514 . . . . 0.0 111.433 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.93 -46.09 89.43 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-O 121.938 0.875 . . . . 0.0 113.079 177.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -65.75 -41.12 92.5 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 120.729 -1.232 . . . . 0.0 112.369 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.62 -38.89 89.28 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 117.826 -1.083 . . . . 0.0 112.277 171.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -55.24 -53.36 56.99 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.355 1.434 . . . . 0.0 111.593 170.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.14 -36.2 83.26 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-O 121.159 0.504 . . . . 0.0 112.061 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.5 t -73.49 -40.64 63.94 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.188 -0.945 . . . . 0.0 112.403 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.68 -49.48 58.65 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 117.901 -1.047 . . . . 0.0 109.433 174.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.1 tp -66.48 -29.66 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 119.873 1.215 . . . . 0.0 113.241 -175.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.15 -17.11 62.56 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 173.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 CA--C 1.545 0.771 0 C-N-CA 125.852 1.661 . . . . 0.0 113.146 -178.26 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 1.8 tp . . . . . 0 N--CA 1.471 0.594 0 CA-C-O 118.678 -0.677 . . . . 0.0 112.184 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -43.48 -45.9 6.63 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -55.96 -59.4 4.96 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.876 1.27 . . . . 0.0 111.237 171.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.09 -38.28 73.11 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.177 0.991 . . . . 0.0 113.411 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.33 -49.16 78.71 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 126.327 1.851 . . . . 0.0 111.031 174.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.5 mttm -54.69 -48.2 72.72 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.046 -0.978 . . . . 0.0 111.6 173.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.6 mm -56.67 -48.66 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 CA-C-N 119.026 0.83 . . . . 0.0 111.462 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -58.73 -47.52 84.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.188 0.449 . . . . 0.0 111.579 177.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.81 -49.03 79.11 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.153 1.381 . . . . 0.0 112.075 -176.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.8 pt -68.81 -29.56 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 121.385 -0.822 . . . . 0.0 111.909 173.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.5 t80 . . . . . 0 CA--C 1.541 0.61 0 CA-C-N 119.529 1.059 . . . . 0.0 113.495 176.507 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo . . . . . 0 N--CA 1.459 -0.531 0 CA-C-O 121.704 0.627 . . . . 0.0 111.737 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 29.2 tp60 -63.58 -23.7 67.5 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.367 -0.833 . . . . 0.0 112.219 177.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.1 t -61.86 -51.52 67.88 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.2 1.4 . . . . 0.0 112.184 178.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.9 p -69.06 -37.02 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 O-C-N 121.72 -0.612 . . . . 0.0 111.561 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -60.22 -47.89 84.07 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.917 173.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -68.3 -39.66 81.98 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.458 1.027 . . . . 0.0 112.928 177.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.61 -37.09 82.03 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.097 -1.002 . . . . 0.0 112.246 177.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.89 -20.13 29.51 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.309 1.044 . . . . 0.0 113.571 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.919 0 C-N-CA 126.001 1.72 . . . . 0.0 112.574 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo . . . . . 0 CA--C 1.544 0.998 0 CA-C-O 119.083 -0.465 . . . . 0.0 111.419 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -71.95 -20.47 25.6 Favored 'Trans proline' 0 CA--C 1.55 1.28 0 CA-C-O 115.652 -1.895 . . . . 0.0 116.121 167.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.36 166.5 29.1 Favored 'Trans proline' 0 C--N 1.363 1.303 0 CA-C-N 124.427 2.617 . . . . 0.0 112.219 176.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -59.16 132.37 46.58 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.859 2.372 . . . . 0.0 111.361 169.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -49.82 -46.47 51.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.273 0.629 . . . . 0.0 110.848 169.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.4 35.44 1.1 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.93 2.492 . . . . 0.0 113.785 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.12 110.75 0.19 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.497 1.519 . . . . 0.0 113.864 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.46 18.08 0.28 Allowed Glycine 0 CA--C 1.539 1.588 0 C-N-CA 125.453 1.501 . . . . 0.0 115.717 -174.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.4 160.84 38.09 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 125.857 1.663 . . . . 0.0 112.667 -170.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.09 170.35 20.58 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.504 2.803 . . . . 0.0 113.298 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -53.75 -35.24 61.02 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.49 -40.53 65.44 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.325 1.45 . . . . 0.0 112.692 173.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.5 t -81.45 -45.27 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 C-N-CA 125.398 1.479 . . . . 0.0 112.203 174.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 92.8 t -54.64 -38.6 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 123.573 0.749 . . . . 0.0 111.07 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -63.35 -50.6 69.35 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.202 -0.936 . . . . 0.0 112.084 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.41 -48.65 71.37 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.018 0.827 . . . . 0.0 112.356 176.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.11 -53.69 39.47 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.719 1.208 . . . . 0.0 111.597 171.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -62.96 -47.52 82.82 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -59.33 -41.36 88.96 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.583 1.153 . . . . 0.0 110.888 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 tp -60.91 -52.01 66.84 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 122.575 0.35 . . . . 0.0 111.306 169.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.45 -33.78 68.3 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 178.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -55.14 -35.16 64.43 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 120.449 1.477 . . . . 0.0 113.319 177.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -72.81 -25.26 61.08 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.993 1.317 . . . . 0.0 113.277 172.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -109.83 14.11 23.31 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 126.216 1.806 . . . . 0.0 113.488 -174.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -21.05 60.18 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.289 -1.507 . . . . 0.0 113.814 -171.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.6 p -109.22 2.47 20.95 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.474 2.31 . . . . 0.0 114.316 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -76.56 170.81 15.72 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.064 1.745 . . . . 0.0 111.906 176.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.51 172.02 12.02 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.768 1.227 . . . . 0.0 112.307 173.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -49.45 -63.5 1.66 Allowed Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 127.294 2.238 . . . . 0.0 112.302 173.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -62.21 -32.47 82.57 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 122.755 2.303 . . . . 0.0 113.328 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -64.65 -51.16 64.04 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.679 0.792 . . . . 0.0 111.885 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 50.8 mt -64.74 -52.52 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 124.291 1.036 . . . . 0.0 110.028 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -47.7 -52.05 19.69 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.25 1.82 . . . . 0.0 112.706 178.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -57.71 -44.29 85.8 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.306 0.957 . . . . 0.0 112.702 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.67 -43.29 97.13 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.191 0.997 . . . . 0.0 112.67 174.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.72 -48.98 79.28 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.19 1.396 . . . . 0.0 111.75 173.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -62.95 -37.66 87.96 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 177.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.3 -48.87 73.47 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 7.2 p-90 -73.88 -34.0 64.26 Favored 'General case' 0 CA--C 1.553 1.078 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 173.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -57.82 -32.46 43.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 124.724 1.21 . . . . 0.0 112.485 173.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.39 -15.78 29.4 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 118.677 0.671 . . . . 0.0 112.733 177.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 42.2 m -94.57 -21.44 18.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.947 1.299 . . . . 0.0 113.057 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.9 mt . . . . . 0 N--CA 1.477 0.905 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 179.883 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 . . . . . 0 N--CA 1.471 0.613 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 13.2 mmt -73.84 -45.14 52.98 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.97 -35.24 70.91 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.373 0.533 . . . . 0.0 112.011 173.303 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.65 -50.59 35.12 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.754 1.222 . . . . 0.0 111.263 176.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.8 tptt -55.74 -53.26 58.8 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.783 0.719 . . . . 0.0 110.351 177.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -60.04 -51.73 68.41 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.923 1.289 . . . . 0.0 111.991 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.16 -45.8 93.15 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.599 1.09 . . . . 0.0 113.081 177.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -65.64 -46.65 78.42 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.731 0.813 . . . . 0.0 111.721 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 48.7 mt -57.69 -51.13 70.8 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.365 1.066 . . . . 0.0 111.014 172.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.52 88.62 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.705 0.802 . . . . 0.0 112.142 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -59.43 -50.92 72.08 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.329 1.052 . . . . 0.0 112.277 176.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.91 -47.88 84.37 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.835 0.854 . . . . 0.0 112.775 176.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -55.98 -54.21 47.61 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.844 0.858 . . . . 0.0 111.367 173.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.35 -42.27 77.49 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 119.75 1.159 . . . . 0.0 112.781 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -52.49 64.23 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.416 1.086 . . . . 0.0 112.559 171.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.91 -30.72 70.95 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 176.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 52.9 t -73.09 -25.06 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 126.407 1.883 . . . . 0.0 113.003 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.91 -30.86 66.24 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 177.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.7 pttt -86.68 0.2 55.04 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.168 1.387 . . . . 0.0 114.277 173.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.7 ttm -102.3 -160.3 0.78 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.67 1.988 . . . . 0.0 111.822 -173.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.18 156.12 22.47 Favored Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 125.391 1.476 . . . . 0.0 113.757 177.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.06 -46.19 1.62 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.415 2.743 . . . . 0.0 112.858 -176.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.71 -32.22 70.32 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.153 0.981 . . . . 0.0 112.463 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.72 -49.0 72.56 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.231 0.613 . . . . 0.0 109.96 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -54.33 -43.47 71.25 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 118.564 -0.731 . . . . 0.0 111.464 173.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -59.25 -54.71 43.76 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.255 0.934 . . . . 0.0 110.871 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.77 -49.01 79.24 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 177.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -70.37 -35.79 73.74 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.93 -44.71 88.6 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.906 1.23 . . . . 0.0 111.24 172.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -44.66 82.55 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.824 0.85 . . . . 0.0 111.883 172.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.73 -36.49 83.75 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 121.504 -0.748 . . . . 0.0 112.721 173.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.1 t -72.22 -37.63 69.16 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.786 -1.196 . . . . 0.0 112.644 -177.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -71.08 -51.4 25.4 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 118.911 -0.566 . . . . 0.0 110.032 173.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.5 tt -63.41 -29.77 48.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-N 119.111 0.869 . . . . 0.0 112.881 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.43 -24.2 63.3 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 177.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 N--CA 1.475 0.785 0 C-N-CA 124.473 1.109 . . . . 0.0 113.758 170.912 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -47.49 -36.7 10.58 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.56 1.144 . . . . 0.0 113.283 171.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.9 mttt -60.47 -59.42 5.43 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.028 0.831 . . . . 0.0 111.238 173.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.55 -37.44 87.55 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.036 0.835 . . . . 0.0 111.942 -175.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.6 tm0? -53.27 -51.66 61.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.2 1.0 . . . . 0.0 110.892 171.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -59.51 -49.22 78.62 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 118.05 -0.976 . . . . 0.0 112.57 176.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 33.9 mm -50.74 -48.57 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.64 1.176 . . . . 0.0 110.947 174.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -66.8 -43.26 84.32 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 121.286 -0.884 . . . . 0.0 112.194 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.51 -42.52 92.43 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.524 1.129 . . . . 0.0 112.636 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.7 pp -74.86 -40.12 45.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 121.685 -0.634 . . . . 0.0 111.861 172.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 67.2 t80 . . . . . 0 N--CA 1.474 0.729 0 C-N-CA 124.731 1.213 . . . . 0.0 113.427 179.873 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 CA--C 1.535 0.548 0 CA-C-O 121.679 0.616 . . . . 0.0 112.584 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -59.22 -22.09 60.52 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 11.2 t -64.17 -51.7 62.56 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.538 1.063 . . . . 0.0 111.793 174.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.9 p -73.88 -38.01 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 O-C-N 121.7 -0.625 . . . . 0.0 111.502 178.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 mmmt -58.11 -49.5 76.73 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 118.521 -0.752 . . . . 0.0 111.896 172.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -68.2 -39.3 82.48 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.701 1.137 . . . . 0.0 113.388 178.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -67.23 -34.72 78.06 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.474 1.034 . . . . 0.0 112.641 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.51 -21.4 26.98 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.095 0.958 . . . . 0.0 113.148 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 C-N-CA 125.392 1.477 . . . . 0.0 113.909 177.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo . . . . . 0 CA--C 1.544 0.998 0 CA-C-O 119.189 -0.421 . . . . 0.0 111.491 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -70.32 -22.53 29.39 Favored 'Trans proline' 0 CA--C 1.552 1.402 0 CA-C-O 115.727 -1.864 . . . . 0.0 115.817 163.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.93 169.32 19.4 Favored 'Trans proline' 0 C--N 1.363 1.309 0 CA-C-N 124.222 2.544 . . . . 0.0 112.484 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -59.86 129.3 29.95 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.398 2.065 . . . . 0.0 110.357 171.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -47.67 -47.86 29.29 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.141 0.576 . . . . 0.0 110.964 170.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -91.56 38.77 0.99 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 128.997 2.919 . . . . 0.0 114.242 177.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.5 112.69 0.41 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.511 1.125 . . . . 0.0 113.609 174.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 143.65 -12.86 2.21 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.958 1.742 . . . . 0.0 114.616 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.31 161.29 75.45 Favored Pre-proline 0 CA--C 1.558 1.281 0 C-N-CA 125.342 1.457 . . . . 0.0 113.706 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -75.7 172.72 15.77 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.913 3.075 . . . . 0.0 113.675 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -53.31 -37.76 62.56 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.851 1.261 . . . . 0.0 113.821 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -53.24 -41.14 65.14 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.024 1.33 . . . . 0.0 112.696 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.6 t -80.47 -42.23 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 124.599 1.16 . . . . 0.0 111.983 174.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -54.81 -39.31 47.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-N 118.593 0.633 . . . . 0.0 110.688 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.3 tptm -61.16 -50.65 72.29 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.079 -1.013 . . . . 0.0 112.137 174.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.6 -50.4 68.15 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.177 0.591 . . . . 0.0 111.816 176.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.44 -50.58 59.47 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.807 0.843 . . . . 0.0 111.9 170.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.15 -47.45 85.86 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.285 0.948 . . . . 0.0 112.819 -176.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -70.96 -32.28 69.1 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.949 -0.47 . . . . 0.0 111.899 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.3 tp -64.35 -49.15 72.81 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.775 0.83 . . . . 0.0 111.516 170.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -66.53 -29.51 69.62 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.926 1.29 . . . . 0.0 114.448 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.6 mttm -54.7 -51.84 64.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 120.062 1.301 . . . . 0.0 112.833 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.95 -17.93 64.59 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.561 1.144 . . . . 0.0 113.687 173.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -108.79 18.65 20.55 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.543 1.937 . . . . 0.0 113.693 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.09 -20.46 65.98 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 120.18 -1.575 . . . . 0.0 113.512 -176.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -103.51 6.76 37.65 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 126.859 2.064 . . . . 0.0 112.991 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -73.73 -172.55 1.28 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.503 1.521 . . . . 0.0 112.704 173.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 m -123.48 170.44 10.38 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 128.098 2.559 . . . . 0.0 110.453 -178.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.7 -56.78 7.89 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.849 1.659 . . . . 0.0 112.637 175.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -68.82 -41.99 5.03 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.212 1.941 . . . . 0.0 113.072 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.53 -41.56 94.68 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.379 -1.451 . . . . 0.0 112.654 -178.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 64.3 mt -69.46 -53.43 24.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 123.588 0.755 . . . . 0.0 109.641 174.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -58.63 -35.39 72.42 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.037 0.835 . . . . 0.0 111.662 -174.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -54.31 -60.9 2.72 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.337 1.455 . . . . 0.0 112.579 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.6 -36.88 85.26 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.074 0.549 . . . . 0.0 112.078 -178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -63.06 -48.97 76.39 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.437 1.095 . . . . 0.0 111.574 174.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -65.23 -34.13 77.63 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 121.568 -0.708 . . . . 0.0 112.363 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.22 -50.87 66.12 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.454 -0.779 . . . . 0.0 112.574 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 7.8 p-90 -73.88 -31.33 63.08 Favored 'General case' 0 CA--C 1.557 1.249 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 170.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.46 -32.48 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 O-C-N 120.243 -1.536 . . . . 0.0 111.813 174.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -59.2 -18.62 38.23 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.583 -0.698 . . . . 0.0 112.366 176.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -97.61 -13.59 21.48 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.861 1.264 . . . . 0.0 113.237 177.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 22.0 mt . . . . . 0 N--CA 1.474 0.771 0 CA-C-N 119.048 0.84 . . . . 0.0 112.667 174.777 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.02 -48.53 73.58 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.383 1.073 . . . . 0.0 112.075 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -54.73 -39.99 68.8 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.517 0.727 . . . . 0.0 111.556 172.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.25 -51.17 56.34 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.798 0.726 . . . . 0.0 111.454 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -60.35 -48.16 82.96 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.73 0.812 . . . . 0.0 111.027 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -61.24 -49.83 75.53 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.067 1.347 . . . . 0.0 112.089 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.82 -51.63 68.22 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.788 1.176 . . . . 0.0 112.86 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -62.78 -48.36 79.49 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.811 -0.556 . . . . 0.0 112.465 178.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.1 tp -54.46 -51.24 65.63 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.184 0.994 . . . . 0.0 110.955 174.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.78 -42.92 99.61 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.581 1.152 . . . . 0.0 112.072 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -58.17 -50.84 72.11 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.824 1.193 . . . . 0.0 111.466 174.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.34 -47.86 80.42 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.762 0.825 . . . . 0.0 112.713 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -54.5 -56.29 20.37 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.209 1.004 . . . . 0.0 111.068 172.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.82 -40.81 73.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.519 1.128 . . . . 0.0 113.205 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.51 -52.54 65.2 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 171.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.19 -29.76 70.09 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 176.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.6 t -73.13 -26.66 23.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 125.868 1.667 . . . . 0.0 112.678 175.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.56 -34.32 64.64 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.5 pttt -85.03 1.71 46.46 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.286 1.435 . . . . 0.0 114.347 175.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.7 ttm -103.25 -159.27 0.71 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.985 2.114 . . . . 0.0 111.695 -174.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.74 156.71 11.81 Favored Pre-proline 0 N--CA 1.479 1.003 0 C-N-CA 125.283 1.433 . . . . 0.0 113.864 176.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.43 -45.54 1.73 Allowed 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.448 2.765 . . . . 0.0 112.803 -177.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -61.3 -30.71 70.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.147 0.979 . . . . 0.0 112.438 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.76 -48.44 71.82 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.837 0.455 . . . . 0.0 110.23 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.19 -44.62 68.07 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.385 173.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm -59.53 -54.77 42.68 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.034 0.833 . . . . 0.0 110.863 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.08 -49.14 78.81 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.698 -0.626 . . . . 0.0 112.481 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -66.55 -32.94 74.61 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.05 -46.57 80.68 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.663 1.119 . . . . 0.0 111.577 172.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -56.91 -47.06 81.45 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 118.891 0.769 . . . . 0.0 111.662 172.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.6 tp -63.06 -38.75 92.44 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 176.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 21.7 t -71.13 -42.97 68.52 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.69 -1.256 . . . . 0.0 112.256 -178.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.38 -46.11 70.92 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 118.666 -0.683 . . . . 0.0 110.624 175.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.3 tp -66.47 -33.72 65.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 119.263 0.938 . . . . 0.0 111.717 -178.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.04 -32.77 74.45 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 . . . . . 0 N--CA 1.471 0.577 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 173.234 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -46.93 -37.72 9.41 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.873 1.269 . . . . 0.0 113.429 -178.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -61.1 -59.42 5.37 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.864 0.866 . . . . 0.0 110.947 172.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -63.81 -33.63 76.1 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.794 0.724 . . . . 0.0 112.285 -177.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.07 -50.99 71.96 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.83 1.252 . . . . 0.0 111.426 173.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.9 -48.47 79.79 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.111 0.964 . . . . 0.0 111.03 173.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 18.4 mm -53.31 -50.59 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 124.378 1.071 . . . . 0.0 111.322 176.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -63.13 -44.44 95.56 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.779 1.172 . . . . 0.0 112.887 176.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.81 -49.0 78.1 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.077 0.951 . . . . 0.0 110.784 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.4 pt -70.49 -38.86 75.2 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 CA-C-O 118.243 -0.884 . . . . 0.0 112.629 173.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 81.6 t80 . . . . . 0 N--CA 1.475 0.783 0 CA-C-N 121.006 1.73 . . . . 0.0 113.075 -178.62 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo . . . . . 0 CA--C 1.537 0.63 0 CA-C-O 121.743 0.643 . . . . 0.0 111.904 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -60.53 -27.33 67.54 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.401 -0.812 . . . . 0.0 113.036 173.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 65.6 m -60.46 -51.71 68.32 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.435 1.471 . . . . 0.0 112.381 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.8 p -68.56 -40.15 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.811 -0.556 . . . . 0.0 111.638 175.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 mmtt -58.16 -48.1 81.33 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.502 174.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -69.05 -38.17 78.95 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.674 1.125 . . . . 0.0 113.444 177.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -69.29 -37.09 77.66 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.605 1.093 . . . . 0.0 112.326 177.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.83 -20.82 28.57 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.682 1.193 . . . . 0.0 113.132 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.11 0 C-N-CA 126.605 1.962 . . . . 0.0 113.601 177.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo . . . . . 0 CA--C 1.546 1.081 0 N-CA-C 111.079 -0.393 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -69.47 -22.8 32.89 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 CA-C-O 115.381 -2.008 . . . . 0.0 115.995 164.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.89 169.9 20.13 Favored 'Trans proline' 0 C--N 1.363 1.333 0 CA-C-N 124.487 2.638 . . . . 0.0 113.451 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -62.21 121.24 9.17 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.18 2.586 . . . . 0.0 111.975 175.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -56.72 -19.14 15.17 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 171.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.29 36.69 4.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 129.317 3.047 . . . . 0.0 112.415 178.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.16 110.89 0.24 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.401 1.48 . . . . 0.0 113.007 175.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.17 13.11 0.2 Allowed Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.916 1.246 . . . . 0.0 115.766 -174.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -116.76 160.02 38.28 Favored Pre-proline 0 CA--C 1.554 1.114 0 C-N-CA 125.663 1.585 . . . . 0.0 112.67 -170.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -73.82 171.4 17.94 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.423 2.749 . . . . 0.0 113.299 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -55.35 -34.01 63.9 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -53.3 -40.71 64.96 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.249 1.42 . . . . 0.0 112.779 171.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 56.0 t -78.75 -44.18 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 124.508 1.123 . . . . 0.0 111.986 173.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 73.7 t -53.91 -39.52 40.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-N 118.816 0.735 . . . . 0.0 111.211 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 tptm -62.78 -50.45 70.99 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.038 -1.038 . . . . 0.0 112.223 174.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.63 -49.24 71.0 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.258 0.623 . . . . 0.0 111.691 176.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.89 -51.19 58.56 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.29 1.036 . . . . 0.0 111.976 170.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.44 -47.3 86.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.881 1.218 . . . . 0.0 113.312 -177.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -65.7 -40.41 92.25 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.895 -0.503 . . . . 0.0 110.979 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.2 tp -61.66 -46.38 89.99 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.862 0.865 . . . . 0.0 111.524 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -63.16 -40.8 98.58 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.714 -1.241 . . . . 0.0 113.8 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.5 mmtp -56.06 -36.0 67.56 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 119.262 0.937 . . . . 0.0 112.974 174.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.68 -38.35 70.64 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.274 1.43 . . . . 0.0 113.497 173.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -98.3 20.39 12.65 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.538 1.535 . . . . 0.0 113.168 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -66.67 -17.08 64.66 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 119.813 -1.804 . . . . 0.0 113.923 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.0 p -95.35 2.01 54.51 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 127.312 2.245 . . . . 0.0 114.363 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -84.08 179.42 7.51 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.652 1.581 . . . . 0.0 111.163 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.44 170.8 7.73 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.673 1.989 . . . . 0.0 111.068 177.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -47.78 -58.35 7.89 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 124.987 1.315 . . . . 0.0 112.221 175.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.75 -36.85 17.57 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.044 1.829 . . . . 0.0 114.26 178.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.99 -45.08 96.25 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 120.959 -1.088 . . . . 0.0 111.918 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.8 mt -69.46 -48.53 66.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-O 118.665 -0.683 . . . . 0.0 110.552 175.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -52.31 -41.11 62.68 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.244 0.929 . . . . 0.0 111.249 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.64 -50.75 71.3 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.215 1.406 . . . . 0.0 112.63 177.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.09 -43.31 95.62 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.45 0.7 . . . . 0.0 112.278 176.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -63.26 -48.54 77.74 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.727 0.811 . . . . 0.0 110.525 175.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -60.41 -31.27 70.22 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 176.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.16 -51.75 68.67 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.437 -0.789 . . . . 0.0 112.072 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -73.84 -31.22 63.1 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 112.986 0.735 . . . . 0.0 112.986 173.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -57.82 -32.89 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 125.6 1.56 . . . . 0.0 112.993 174.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -57.77 -15.75 9.1 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.24 -14.84 18.3 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.469 1.507 . . . . 0.0 113.549 176.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.4 mt . . . . . 0 N--CA 1.475 0.807 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 176.24 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -61.47 -53.39 57.04 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 121.522 -0.736 . . . . 0.0 112.437 177.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.8 mmtm -55.74 -35.55 66.29 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.2 1.0 . . . . 0.0 111.817 176.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.12 -51.02 42.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.071 0.948 . . . . 0.0 111.034 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.69 -46.4 89.19 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.694 0.798 . . . . 0.0 111.55 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -62.72 -51.71 66.13 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.675 1.19 . . . . 0.0 112.019 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.11 -46.03 86.23 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.039 0.836 . . . . 0.0 112.432 177.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -63.42 -46.67 85.26 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.038 0.935 . . . . 0.0 112.46 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -56.44 -50.97 70.12 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.223 1.009 . . . . 0.0 111.325 171.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.12 -40.47 89.82 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.248 0.619 . . . . 0.0 111.986 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -61.45 -50.23 73.6 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.764 1.226 . . . . 0.0 111.668 175.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.68 -47.05 85.81 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.542 0.61 . . . . 0.0 112.332 177.055 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -57.24 -53.56 56.71 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.922 0.889 . . . . 0.0 111.26 175.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -50.82 -45.69 59.63 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.3 1.44 . . . . 0.0 113.155 174.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.3 -50.87 72.09 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.944 1.298 . . . . 0.0 111.973 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.38 -34.14 77.6 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 172.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.3 t -72.2 -23.46 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 124.927 1.291 . . . . 0.0 112.578 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.03 -31.25 60.95 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.68 -1.263 . . . . 0.0 114.382 175.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.93 -2.79 52.55 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.986 1.314 . . . . 0.0 114.298 176.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.21 -160.27 0.79 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.832 2.053 . . . . 0.0 112.036 -174.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -52.57 155.05 4.08 Favored Pre-proline 0 N--CA 1.479 0.985 0 C-N-CA 126.529 1.932 . . . . 0.0 113.485 171.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -67.05 -49.96 1.21 Allowed 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.296 2.664 . . . . 0.0 112.269 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -61.08 -27.76 68.59 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.967 1.307 . . . . 0.0 113.298 178.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.85 -51.96 62.24 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.913 0.485 . . . . 0.0 110.086 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.2 -42.3 66.15 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.265 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.2 mmtm -60.29 -54.73 42.2 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.564 0.62 . . . . 0.0 110.654 -178.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.38 84.04 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.424 0.689 . . . . 0.0 112.788 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.14 -40.51 86.76 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 177.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.96 -48.35 82.05 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.378 1.071 . . . . 0.0 111.074 171.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.63 -43.76 72.55 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.364 1.066 . . . . 0.0 112.057 173.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.79 -34.59 75.8 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 118.893 0.77 . . . . 0.0 112.866 176.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.9 t -71.96 -43.73 64.72 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.754 -1.216 . . . . 0.0 113.016 177.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -35.5 68.91 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.316 1.046 . . . . 0.0 111.705 176.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 5.6 tt -73.05 -32.73 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 119.253 0.933 . . . . 0.0 111.906 175.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.36 -16.66 37.27 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.546 0.797 0 C-N-CA 125.713 1.605 . . . . 0.0 113.566 175.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -47.63 -33.87 7.25 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.297 1.439 . . . . 0.0 113.272 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -59.38 -59.57 5.24 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.797 0.839 . . . . 0.0 111.053 171.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.09 -37.83 88.87 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.19 0.905 . . . . 0.0 111.849 -176.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -53.92 -52.02 61.9 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.67 0.788 . . . . 0.0 111.17 172.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.6 tttt -58.17 -51.78 68.31 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.683 175.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 25.5 mm -49.78 -46.92 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.438 1.095 . . . . 0.0 110.584 178.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -69.16 -42.54 75.78 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.635 0.774 . . . . 0.0 112.795 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.45 -31.99 71.96 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.229 1.412 . . . . 0.0 113.672 174.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 29.3 pt -87.32 -31.31 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 119.113 0.869 . . . . 0.0 112.596 171.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 66.2 t80 . . . . . 0 N--CA 1.466 0.335 0 O-C-N 120.843 -1.16 . . . . 0.0 111.911 176.825 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 CA--C 1.536 0.589 0 CA-C-O 121.545 0.56 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -60.35 -24.34 64.99 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 174.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.3 p -63.93 -51.32 64.96 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.691 1.132 . . . . 0.0 112.019 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.4 p -71.88 -39.31 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.853 -0.529 . . . . 0.0 111.576 176.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -56.71 -51.62 68.1 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 118.607 -0.711 . . . . 0.0 112.001 172.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -67.79 -42.38 81.74 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.578 1.081 . . . . 0.0 112.247 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.83 -35.85 81.28 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.115 -0.991 . . . . 0.0 112.546 176.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.18 -19.41 24.25 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.113 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 . . . . . 0 N--CA 1.48 1.025 0 C-N-CA 126.106 1.762 . . . . 0.0 113.065 176.378 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo . . . . . 0 CA--C 1.544 0.984 0 CA-C-O 119.257 -0.393 . . . . 0.0 111.849 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.14 -21.66 26.93 Favored 'Trans proline' 0 CA--C 1.553 1.467 0 C-N-CA 122.591 2.194 . . . . 0.0 116.654 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.4 167.41 25.36 Favored 'Trans proline' 0 C--N 1.361 1.216 0 CA-C-N 124.241 2.55 . . . . 0.0 112.271 176.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.457 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 33.3 Cg_endo -58.27 133.33 54.43 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.803 2.335 . . . . 0.0 111.752 170.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -49.24 -48.68 45.47 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.397 0.679 . . . . 0.0 111.635 171.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -81.34 18.1 1.2 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 127.128 2.171 . . . . 0.0 115.03 -178.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.36 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.956 2.102 . . . . 0.0 115.467 -172.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.19 24.22 0.1 Allowed Glycine 0 CA--C 1.538 1.502 0 C-N-CA 124.979 1.276 . . . . 0.0 114.758 -173.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -121.76 157.74 56.31 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 125.856 1.662 . . . . 0.0 111.944 -173.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -73.99 169.14 23.11 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.182 2.588 . . . . 0.0 113.205 -177.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -52.09 -41.06 62.1 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.585 1.554 . . . . 0.0 113.275 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -54.22 -42.01 69.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.09 1.356 . . . . 0.0 112.91 173.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.5 t -78.9 -39.24 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.371 1.069 . . . . 0.0 111.503 176.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 46.9 t -57.04 -40.08 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.689 0.795 . . . . 0.0 111.098 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.9 tptt -63.02 -50.63 69.94 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.9 -1.125 . . . . 0.0 111.968 174.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -52.84 -48.42 67.02 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.501 0.72 . . . . 0.0 112.232 174.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.457 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 1.5 t80 -50.66 -53.66 29.24 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.593 1.157 . . . . 0.0 111.964 168.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.35 -47.48 85.86 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -62.11 -42.87 99.67 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.541 0.736 . . . . 0.0 111.166 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.4 tp -58.25 -47.7 82.75 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.522 0.729 . . . . 0.0 111.258 172.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -64.39 -30.75 71.79 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -57.89 -29.97 65.49 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 120.392 1.451 . . . . 0.0 113.279 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -46.34 68.59 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.613 1.165 . . . . 0.0 112.105 169.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -94.16 17.68 12.17 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.336 1.854 . . . . 0.0 114.046 -174.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.76 -25.03 66.2 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 120.044 -1.66 . . . . 0.0 113.316 -172.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.2 p -87.51 -0.48 56.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.555 1.942 . . . . 0.0 114.284 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -81.15 161.1 24.2 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.13 1.372 . . . . 0.0 112.245 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -87.15 171.28 10.8 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.749 2.02 . . . . 0.0 111.651 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -41.91 -59.75 2.39 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 127.487 2.315 . . . . 0.0 113.237 172.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -74.06 -31.34 7.99 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 122.048 1.832 . . . . 0.0 113.578 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.69 -42.84 90.76 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.874 -1.141 . . . . 0.0 111.76 177.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.3 mt -65.97 -53.34 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 123.451 0.7 . . . . 0.0 109.824 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -56.82 -39.16 73.66 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.262 0.937 . . . . 0.0 112.216 -174.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.1 tttm -59.6 -57.41 13.05 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.575 1.15 . . . . 0.0 112.871 177.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -63.18 -38.04 89.6 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.865 -0.522 . . . . 0.0 111.878 -178.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.12 -48.77 77.12 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.62 1.168 . . . . 0.0 111.402 174.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.52 -41.19 72.81 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 121.389 -0.819 . . . . 0.0 113.027 173.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.54 -47.56 73.03 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -176.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 7.4 p-90 -73.99 -36.63 64.53 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 114.59 1.329 . . . . 0.0 114.59 168.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.07 -33.37 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 125.363 1.465 . . . . 0.0 112.326 175.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -59.9 -12.42 7.64 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.055 0.942 . . . . 0.0 112.931 177.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.1 m -109.86 -10.7 14.74 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.767 1.627 . . . . 0.0 112.537 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 16.4 mt . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 173.761 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 . . . . . 0 CA--C 1.543 0.7 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 9.8 tmm? -61.79 -51.32 68.75 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 121.514 -0.741 . . . . 0.0 112.542 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -63.82 -28.6 69.97 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.62 0.368 . . . . 0.0 111.399 177.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.43 -51.46 14.87 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.56 1.144 . . . . 0.0 111.916 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.48 -52.67 64.64 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.464 0.575 . . . . 0.0 110.139 174.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.38 -49.19 78.13 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.251 -178.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.36 -46.55 88.15 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.867 1.212 . . . . 0.0 113.064 177.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -66.16 -46.86 75.93 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 118.847 0.749 . . . . 0.0 112.435 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 75.7 mt -57.75 -49.38 76.76 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.463 1.105 . . . . 0.0 110.855 173.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.56 -43.93 96.72 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.188 -0.91 . . . . 0.0 112.233 177.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.7 mtpt -56.21 -50.68 70.57 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.458 1.481 . . . . 0.0 112.421 173.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.49 -51.32 67.92 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 177.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -57.09 -51.99 67.09 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.69 0.796 . . . . 0.0 111.715 175.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.08 -44.62 67.67 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.91 1.284 . . . . 0.0 112.113 176.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -57.18 -52.29 65.9 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.642 0.655 . . . . 0.0 112.583 174.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.31 -30.97 70.95 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 178.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.6 t -72.74 -25.37 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 126.79 2.036 . . . . 0.0 112.913 175.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.44 -30.68 63.15 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.178 1.547 . . . . 0.0 115.178 176.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 pttt -88.73 3.15 51.9 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 125.821 1.648 . . . . 0.0 114.181 172.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 9.1 ttm -106.31 -163.55 0.93 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.695 1.998 . . . . 0.0 111.333 -173.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.15 152.93 20.23 Favored Pre-proline 0 N--CA 1.481 1.091 0 C-N-CA 125.702 1.601 . . . . 0.0 114.209 178.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -68.52 -46.51 1.89 Allowed 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.885 3.057 . . . . 0.0 113.303 -173.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.92 -37.19 71.13 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.411 1.484 . . . . 0.0 112.49 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.0 -46.57 80.88 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.329 0.652 . . . . 0.0 109.828 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -45.39 58.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.418 1.087 . . . . 0.0 111.977 174.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -65.85 -51.62 57.34 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.707 1.203 . . . . 0.0 112.069 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.68 -45.2 92.78 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.167 0.987 . . . . 0.0 113.0 177.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.94 -36.93 70.04 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.065 -1.022 . . . . 0.0 113.234 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.79 97.21 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.496 1.044 . . . . 0.0 111.714 171.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -53.97 -50.51 66.37 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.218 1.407 . . . . 0.0 111.625 170.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 9.6 tp -59.53 -39.69 84.72 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 174.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.5 t -72.62 -38.36 67.8 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.189 -0.945 . . . . 0.0 112.684 -175.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -71.26 -48.66 49.67 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.443 0.697 . . . . 0.0 110.833 174.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.7 tt -67.12 -27.71 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.08 -34.48 70.2 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 . . . . . 0 CA--C 1.542 0.661 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 171.011 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -49.47 -35.97 21.28 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.44 1.496 . . . . 0.0 112.975 174.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -57.12 -59.38 5.17 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.595 1.158 . . . . 0.0 111.48 173.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.96 -36.92 85.94 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.582 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.63 -47.25 80.1 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.709 1.204 . . . . 0.0 110.931 174.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.74 -52.41 62.6 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 117.529 -1.224 . . . . 0.0 112.473 168.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 8.9 mm -52.68 -45.23 48.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 CA-C-N 119.705 1.139 . . . . 0.0 111.678 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -67.37 -45.09 77.31 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.043 0.937 . . . . 0.0 112.018 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.84 -47.37 86.65 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.57 1.148 . . . . 0.0 112.132 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -69.05 -38.62 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.879 -0.513 . . . . 0.0 111.986 173.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 71.9 t80 . . . . . 0 N--CA 1.474 0.733 0 CA-C-N 120.181 1.355 . . . . 0.0 112.859 175.8 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo . . . . . 0 CA--C 1.536 0.601 0 CA-C-O 121.875 0.698 . . . . 0.0 113.251 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 68.5 mm-40 -55.43 -27.84 50.5 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.072 0.949 . . . . 0.0 112.722 176.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.24 -51.69 68.7 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.584 1.154 . . . . 0.0 112.707 176.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -70.96 -46.37 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 O-C-N 121.609 -0.682 . . . . 0.0 109.642 175.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -58.48 -40.96 84.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 118.936 -1.106 . . . . 0.0 110.023 -173.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -65.54 -46.59 78.98 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.109 1.363 . . . . 0.0 112.712 173.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -37.24 79.01 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 119.591 1.087 . . . . 0.0 112.796 179.078 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.2 pp -89.01 -21.53 23.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.491 0.716 . . . . 0.0 112.825 -179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 . . . . . 0 N--CA 1.478 0.974 0 C-N-CA 125.814 1.646 . . . . 0.0 113.839 176.106 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo . . . . . 0 CA--C 1.547 1.133 0 CA-C-O 118.999 -0.5 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -68.53 -21.85 39.33 Favored 'Trans proline' 0 CA--C 1.554 1.499 0 N-CA-C 116.977 1.876 . . . . 0.0 116.977 170.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.89 166.98 27.22 Favored 'Trans proline' 0 C--N 1.362 1.269 0 CA-C-N 124.264 2.559 . . . . 0.0 112.882 176.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.16 148.08 84.63 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.073 2.516 . . . . 0.0 112.543 175.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -61.18 -24.66 66.47 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -112.57 32.87 5.31 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.869 2.468 . . . . 0.0 111.629 177.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.18 116.55 0.84 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.86 1.264 . . . . 0.0 113.148 171.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.99 -11.53 2.85 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 126.362 1.934 . . . . 0.0 113.629 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.97 158.89 52.57 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.809 1.644 . . . . 0.0 112.453 -178.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.65 174.18 12.67 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.821 2.348 . . . . 0.0 113.609 -178.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -52.09 -35.72 48.68 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.49 1.516 . . . . 0.0 113.094 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -52.9 -41.26 64.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.459 1.503 . . . . 0.0 113.178 172.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 69.7 t -80.75 -41.24 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.488 1.115 . . . . 0.0 111.828 175.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 43.2 t -56.58 -37.82 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.382 0.673 . . . . 0.0 111.299 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.2 tptt -62.12 -50.69 70.88 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.352 -0.842 . . . . 0.0 112.312 172.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.27 -46.8 76.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.523 0.729 . . . . 0.0 111.532 177.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -51.78 -53.8 35.78 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.678 1.191 . . . . 0.0 111.747 168.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.25 -47.45 83.52 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.671 1.123 . . . . 0.0 113.925 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.74 -41.33 96.01 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.155 0.582 . . . . 0.0 111.621 178.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.9 tp -60.16 -44.99 94.58 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.21 0.604 . . . . 0.0 111.42 172.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -61.7 -38.82 89.25 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.513 1.925 . . . . 0.0 114.012 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -54.25 -31.1 52.63 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 174.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -68.65 -44.96 73.03 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.193 0.997 . . . . 0.0 112.399 175.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -101.41 26.99 6.62 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.741 2.016 . . . . 0.0 112.606 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -24.95 43.79 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.903 1.281 . . . . 0.0 113.918 -179.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.81 -30.53 64.14 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.297 1.839 . . . . 0.0 113.262 176.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.5 mmtt -65.85 142.86 57.78 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.335 1.054 . . . . 0.0 110.212 176.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.59 158.25 34.38 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.464 0.706 . . . . 0.0 109.465 171.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -37.96 -58.99 1.27 Allowed Pre-proline 0 CA--C 1.552 1.056 0 CA-C-O 117.242 -1.361 . . . . 0.0 113.956 173.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -57.98 -44.25 41.49 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.012 3.141 . . . . 0.0 114.536 177.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -58.97 -39.01 80.42 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.922 0.889 . . . . 0.0 111.755 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 25.0 mt -66.07 -47.4 85.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 124.026 0.931 . . . . 0.0 110.362 173.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -52.26 -39.01 59.83 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.15 -57.35 9.88 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 122.091 0.948 . . . . 0.0 113.164 170.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -32.49 74.0 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.284 -0.885 . . . . 0.0 112.551 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.433 HD11 ' HE1' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -62.31 -49.97 73.51 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.015 1.326 . . . . 0.0 110.77 170.942 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -54.66 -35.53 63.62 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.893 0.877 . . . . 0.0 113.131 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.36 45.04 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.433 ' HE1' HD11 ' A' ' 40' ' ' LEU . 9.7 p-90 -73.79 -33.83 64.39 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 174.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -57.74 -31.57 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.401 1.48 . . . . 0.0 111.656 174.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -57.8 -17.84 18.32 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.383 0.992 . . . . 0.0 112.82 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.68 -11.32 23.64 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.172 1.389 . . . . 0.0 113.223 176.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.5 mt . . . . . 0 N--CA 1.475 0.796 0 CA-C-N 119.079 0.854 . . . . 0.0 112.618 171.985 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -59.78 -53.41 58.25 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 123.742 0.817 . . . . 0.0 112.451 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.5 mttm -57.36 -34.47 68.84 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.216 1.006 . . . . 0.0 112.195 175.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.01 -51.38 32.77 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.882 0.873 . . . . 0.0 111.747 178.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.34 -52.45 65.3 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.321 1.048 . . . . 0.0 110.388 176.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -61.31 -49.84 75.4 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.202 1.001 . . . . 0.0 111.951 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.61 -48.72 78.65 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.511 1.505 . . . . 0.0 112.753 177.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -62.44 -53.96 47.23 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.184 0.594 . . . . 0.0 111.988 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.5 tp -54.09 -51.27 64.68 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.08 1.352 . . . . 0.0 110.354 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.81 -48.19 82.14 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 124.119 0.968 . . . . 0.0 111.393 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.96 -50.59 68.52 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 120.747 1.612 . . . . 0.0 112.315 176.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.0 -50.89 71.97 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.628 0.771 . . . . 0.0 112.666 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -58.76 -48.96 79.41 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.746 1.219 . . . . 0.0 110.932 178.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -54.38 -44.31 72.17 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.606 1.962 . . . . 0.0 112.539 174.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -59.02 -50.54 73.71 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.472 0.709 . . . . 0.0 112.014 175.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.19 -38.16 90.07 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 121.221 0.534 . . . . 0.0 112.286 175.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.8 t -69.02 -27.56 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 C-N-CA 125.84 1.656 . . . . 0.0 112.868 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.18 -22.04 6.0 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 174.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.2 pttt -116.45 1.52 12.99 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.96 1.704 . . . . 0.0 114.566 174.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 31.9 tpp -86.56 -83.86 0.18 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.754 1.621 . . . . 0.0 111.175 -177.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.7 150.72 76.57 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 127.579 2.351 . . . . 0.0 112.452 -175.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -71.22 -49.7 0.36 Allowed 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 123.899 3.066 . . . . 0.0 113.372 -176.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.4 -37.97 89.4 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.857 1.263 . . . . 0.0 112.2 177.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.69 -36.06 82.61 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.316 0.646 . . . . 0.0 110.774 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.73 -48.32 66.77 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.087 0.955 . . . . 0.0 111.603 173.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 mttm -63.92 -53.3 52.54 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.238 1.015 . . . . 0.0 111.199 177.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -53.46 -55.49 24.83 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.281 0.632 . . . . 0.0 112.275 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -67.79 -37.67 82.34 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.718 0.807 . . . . 0.0 112.67 -176.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.5 -49.41 77.66 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.398 -0.814 . . . . 0.0 111.076 172.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.21 -41.02 87.61 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.464 1.106 . . . . 0.0 112.526 175.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 7.5 mp -66.88 -38.93 87.22 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 119.352 0.978 . . . . 0.0 112.608 172.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.5 t -71.4 -42.63 68.1 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 120.473 -1.392 . . . . 0.0 113.022 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -49.56 68.42 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.324 0.65 . . . . 0.0 109.614 174.114 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.8 tp -65.46 -28.14 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -178.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.61 -26.87 68.26 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 177.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 . . . . . 0 CA--C 1.547 0.832 0 C-N-CA 124.379 1.071 . . . . 0.0 113.173 173.891 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -43.71 -35.8 1.97 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.502 1.521 . . . . 0.0 114.032 170.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -60.95 -59.38 5.46 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.599 0.76 . . . . 0.0 111.536 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.11 -31.54 72.79 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.831 0.741 . . . . 0.0 111.892 -176.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.36 -52.33 65.71 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.451 0.301 . . . . 0.0 111.445 172.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -54.67 -46.87 74.1 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 117.91 -1.043 . . . . 0.0 111.646 174.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 27.4 mm -52.97 -49.81 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.355 1.062 . . . . 0.0 111.731 174.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 68.6 mm-40 -64.41 -46.22 84.21 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.064 1.302 . . . . 0.0 112.947 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.39 -48.9 77.84 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.124 0.969 . . . . 0.0 111.725 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.59 -40.09 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.161 173.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 87.6 t80 . . . . . 0 N--CA 1.474 0.745 0 CA-C-N 120.304 1.411 . . . . 0.0 113.439 -179.465 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo . . . . . 0 CA--C 1.537 0.625 0 CA-C-O 121.638 0.599 . . . . 0.0 112.188 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -60.89 -24.66 66.15 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 174.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 71.5 m -62.7 -51.61 66.54 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 120.009 1.277 . . . . 0.0 112.044 176.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.6 p -70.22 -38.94 76.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 121.905 -0.497 . . . . 0.0 111.137 176.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.2 tttt -61.21 -45.69 93.52 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.109 0.868 . . . . 0.0 112.071 177.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -69.87 -39.43 76.32 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.057 0.943 . . . . 0.0 113.05 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -67.54 -36.74 81.56 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.199 -0.938 . . . . 0.0 112.412 176.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.23 -19.44 31.64 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.351 1.06 . . . . 0.0 113.26 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 . . . . . 0 N--CA 1.479 0.986 0 C-N-CA 125.951 1.7 . . . . 0.0 113.833 178.158 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo . . . . . 0 CA--C 1.54 0.821 0 CA-C-O 119.154 -0.436 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -68.67 -23.06 36.76 Favored 'Trans proline' 0 CA--C 1.551 1.335 0 CA-C-O 115.882 -1.799 . . . . 0.0 115.511 167.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.02 160.47 49.22 Favored 'Trans proline' 0 C--N 1.363 1.314 0 CA-C-N 124.122 2.508 . . . . 0.0 112.537 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -64.87 130.14 25.24 Favored 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 123.54 2.827 . . . . 0.0 111.454 174.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -52.1 -49.78 62.92 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.125 -0.984 . . . . 0.0 112.505 174.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.16 -2.07 17.33 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -15.48 99.12 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.782 2.833 . . . . 0.0 115.192 -175.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 162.61 -21.69 0.19 Allowed Glycine 0 CA--C 1.537 1.413 0 C-N-CA 124.549 1.071 . . . . 0.0 114.98 -177.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.17 161.56 72.63 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 124.54 1.136 . . . . 0.0 113.135 176.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.47 172.67 15.67 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.438 2.758 . . . . 0.0 113.991 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -52.84 -36.34 58.66 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.991 1.316 . . . . 0.0 113.33 -179.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -54.05 -39.91 66.64 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.513 1.525 . . . . 0.0 112.7 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 72.3 t -83.29 -39.87 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.536 1.534 . . . . 0.0 111.754 176.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 59.4 t -55.9 -39.72 58.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.066 0.946 . . . . 0.0 111.022 177.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 tptm -60.57 -50.64 72.74 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.718 0.807 . . . . 0.0 111.935 172.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.78 -47.15 74.32 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.672 0.669 . . . . 0.0 111.945 178.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -53.48 -53.47 51.03 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.459 1.104 . . . . 0.0 112.06 168.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.21 -47.42 83.51 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 119.086 0.857 . . . . 0.0 113.136 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.15 -37.65 88.07 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.793 0.837 . . . . 0.0 112.054 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.9 tp -60.57 -52.55 64.67 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.559 0.744 . . . . 0.0 111.193 171.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -71.28 -27.34 63.36 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.019 1.328 . . . . 0.0 113.601 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.5 mmtt -52.48 -48.07 66.15 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.029 1.731 . . . . 0.0 112.687 173.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 tttt -67.08 -24.03 65.92 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 178.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -109.75 30.48 6.64 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.32 2.248 . . . . 0.0 112.46 178.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -54.83 -23.3 17.68 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 119.976 -1.703 . . . . 0.0 113.917 -173.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.7 p -77.08 8.17 4.19 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.715 2.806 . . . . 0.0 114.989 172.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.09 171.95 0.23 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.25 1.82 . . . . 0.0 114.112 170.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 m -138.17 170.07 16.68 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 127.773 2.429 . . . . 0.0 109.409 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -40.14 -56.76 3.17 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 127.335 2.254 . . . . 0.0 113.436 175.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.64 -36.51 14.36 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 122.51 2.14 . . . . 0.0 113.856 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.93 -40.91 95.76 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.556 1.071 . . . . 0.0 111.064 178.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 22.6 mt -62.57 -53.39 47.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.44 -38.45 91.17 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 119.017 -1.073 . . . . 0.0 111.909 -175.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.7 ttmt -65.19 -60.17 3.29 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 125.103 1.361 . . . . 0.0 112.138 177.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -59.41 -38.62 81.07 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.678 0.672 . . . . 0.0 112.197 -179.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.22 -51.15 60.46 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.474 176.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -59.01 -33.3 70.56 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.99 -52.17 65.14 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 8.7 p-90 -73.91 -35.02 64.59 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 114.376 1.251 . . . . 0.0 114.376 169.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -57.6 -27.8 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 O-C-N 120.266 -1.521 . . . . 0.0 111.795 176.085 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -56.17 -25.75 47.86 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.775 0.83 . . . . 0.0 112.501 176.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 38.7 p -88.65 -20.97 24.22 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 41.3 mt . . . . . 0 CA--C 1.541 0.616 0 CA-C-N 118.433 0.56 . . . . 0.0 111.909 179.892 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 . . . . . 0 N--CA 1.473 0.693 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.72 -53.31 56.32 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.525 1.13 . . . . 0.0 112.917 176.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 6.2 mtpp -56.66 -36.17 69.25 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 119.053 -0.499 . . . . 0.0 111.847 174.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.14 -49.9 52.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.814 0.846 . . . . 0.0 111.673 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.9 tttt -58.95 -51.16 71.24 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.412 1.085 . . . . 0.0 110.827 177.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.94 -50.1 74.78 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.682 1.193 . . . . 0.0 112.134 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.52 -49.97 71.18 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.179 0.9 . . . . 0.0 113.118 176.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -63.96 -47.11 81.71 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.465 0.706 . . . . 0.0 112.505 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.6 mt -56.46 -46.79 80.19 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.897 0.879 . . . . 0.0 112.032 173.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.25 -48.43 81.49 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.273 1.029 . . . . 0.0 111.182 177.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -50.87 67.41 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 119.963 1.256 . . . . 0.0 112.039 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.61 -48.92 75.38 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.376 0.67 . . . . 0.0 112.345 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.9 m80 -55.51 -54.09 48.29 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.961 0.904 . . . . 0.0 111.515 173.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -54.52 -41.04 69.21 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.897 1.679 . . . . 0.0 112.673 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -51.3 69.34 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.822 0.849 . . . . 0.0 111.935 174.058 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.07 -29.29 69.03 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 175.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 63.8 t -73.02 -28.44 26.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.65 1.98 . . . . 0.0 112.286 175.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.86 -36.36 58.9 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 174.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -90.98 2.17 56.49 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.642 1.577 . . . . 0.0 113.987 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 3.9 ttm -97.43 -77.02 0.5 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.421 1.488 . . . . 0.0 111.519 -174.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.71 149.56 73.33 Favored Pre-proline 0 N--CA 1.481 1.122 0 C-N-CA 126.285 1.834 . . . . 0.0 112.806 -176.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.24 -46.53 0.66 Allowed 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.768 2.978 . . . . 0.0 113.184 -177.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -68.02 -33.06 73.87 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.565 1.146 . . . . 0.0 112.523 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.59 76.04 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.915 0.486 . . . . 0.0 111.228 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.11 -51.77 65.36 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.857 0.753 . . . . 0.0 110.594 169.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -57.27 -54.7 43.82 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.513 1.125 . . . . 0.0 110.849 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.48 -52.53 65.2 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.22 -34.86 78.98 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.352 0.661 . . . . 0.0 112.432 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.3 -48.12 76.85 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 119.716 1.143 . . . . 0.0 110.774 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.25 -45.68 76.08 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.051 0.941 . . . . 0.0 112.34 171.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 8.3 tp -63.1 -39.14 93.82 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 118.836 0.744 . . . . 0.0 112.67 174.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.0 t -71.92 -41.72 67.54 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 120.603 -1.31 . . . . 0.0 112.238 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.61 -42.49 78.06 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.283 0.633 . . . . 0.0 110.869 176.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.9 tp -70.07 -31.46 47.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 118.46 0.573 . . . . 0.0 112.311 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.09 -31.7 72.17 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 . . . . . 0 CA--C 1.545 0.781 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 172.486 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -47.96 -34.19 8.84 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.508 1.523 . . . . 0.0 113.536 172.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -59.2 5.77 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 118.775 0.716 . . . . 0.0 111.304 173.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.89 79.23 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.538 0.735 . . . . 0.0 112.488 -179.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -53.91 -52.23 61.2 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.421 1.088 . . . . 0.0 110.714 169.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -49.61 75.54 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 117.631 -1.176 . . . . 0.0 111.509 175.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.5 mm -54.21 -49.58 61.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 119.53 1.059 . . . . 0.0 111.501 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 69.5 mm-40 -62.06 -44.74 96.03 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.301 -0.874 . . . . 0.0 112.369 176.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.61 -48.95 78.58 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 119.131 0.878 . . . . 0.0 112.329 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -67.15 -35.76 75.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.514 0.725 . . . . 0.0 111.85 176.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.7 t80 . . . . . 0 CA--C 1.542 0.662 0 C-N-CA 123.881 0.872 . . . . 0.0 112.947 175.242 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo . . . . . 0 CA--C 1.535 0.54 0 CA-C-O 121.863 0.693 . . . . 0.0 112.645 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -61.45 -27.6 68.68 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.538 -0.726 . . . . 0.0 112.174 177.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 22.7 t -61.14 -51.69 68.01 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.641 1.109 . . . . 0.0 112.129 177.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.2 p -74.99 -38.76 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.612 -0.68 . . . . 0.0 111.804 178.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -56.98 -51.15 70.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.626 171.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -63.95 -43.52 95.57 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.015 1.28 . . . . 0.0 112.699 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -66.51 -34.43 77.89 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.256 0.935 . . . . 0.0 112.804 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.34 -23.88 24.46 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.207 1.003 . . . . 0.0 113.242 178.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 . . . . . 0 N--CA 1.48 1.046 0 C-N-CA 126.472 1.909 . . . . 0.0 113.187 -179.971 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo . . . . . 0 CA--C 1.541 0.826 0 CA-C-O 119.14 -0.441 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -71.6 -21.3 25.82 Favored 'Trans proline' 0 CA--C 1.553 1.433 0 CA-C-O 115.714 -1.869 . . . . 0.0 116.287 167.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.83 165.98 29.22 Favored 'Trans proline' 0 C--N 1.362 1.275 0 CA-C-N 124.36 2.593 . . . . 0.0 112.356 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.441 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 35.2 Cg_endo -58.77 131.5 42.45 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.52 2.146 . . . . 0.0 111.019 169.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -49.89 -49.6 49.01 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.999 0.52 . . . . 0.0 110.734 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -80.24 28.54 0.3 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.671 1.988 . . . . 0.0 115.081 176.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -40.32 107.62 0.07 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.494 1.518 . . . . 0.0 114.297 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.55 17.11 0.3 Allowed Glycine 0 CA--C 1.537 1.466 0 C-N-CA 124.784 1.183 . . . . 0.0 115.044 -174.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.67 158.23 36.15 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.842 1.657 . . . . 0.0 112.132 -173.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -73.0 167.18 28.05 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.778 2.319 . . . . 0.0 112.732 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -53.78 -38.74 64.78 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.61 1.164 . . . . 0.0 113.093 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.96 -40.14 63.48 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.586 1.554 . . . . 0.0 112.825 173.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.9 t -82.75 -39.71 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.029 1.332 . . . . 0.0 111.713 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.8 t -56.03 -40.25 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.863 0.756 . . . . 0.0 110.955 176.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.4 tptt -61.26 -50.52 72.7 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.081 -1.012 . . . . 0.0 111.866 174.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.0 75.01 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.43 0.692 . . . . 0.0 112.025 178.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.441 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 1.5 t80 -52.82 -53.75 44.11 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.728 1.211 . . . . 0.0 112.273 168.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.66 -47.37 85.9 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.646 1.112 . . . . 0.0 113.579 -178.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -61.15 -38.77 87.62 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.849 0.86 . . . . 0.0 111.407 176.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.5 tp -64.15 -47.69 78.92 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 121.819 -0.55 . . . . 0.0 111.465 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.61 -35.52 76.32 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.576 1.55 . . . . 0.0 114.26 -178.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.22 -31.0 61.12 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.348 1.431 . . . . 0.0 113.025 175.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -70.38 -36.43 74.11 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.721 1.608 . . . . 0.0 112.507 176.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -109.81 20.18 18.31 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.438 1.895 . . . . 0.0 112.375 -176.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -26.1 66.6 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.053 -1.654 . . . . 0.0 113.5 -175.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 33.0 p -85.27 -0.32 54.33 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.659 2.384 . . . . 0.0 114.379 177.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -82.69 167.91 17.76 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 125.418 1.487 . . . . 0.0 112.609 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.21 171.52 9.44 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.926 2.09 . . . . 0.0 111.94 178.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -46.04 -61.16 2.73 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 126.746 2.018 . . . . 0.0 112.595 172.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.35 -38.32 20.75 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 121.894 1.729 . . . . 0.0 112.744 177.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -42.07 99.35 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 120.444 -1.41 . . . . 0.0 112.684 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.1 mt -68.18 -53.34 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 124.25 1.02 . . . . 0.0 110.385 173.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -56.9 -37.62 71.67 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.368 0.986 . . . . 0.0 112.468 -174.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -59.47 -56.99 15.07 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.146 1.378 . . . . 0.0 111.919 177.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -65.59 -35.2 80.15 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.688 0.395 . . . . 0.0 111.919 -178.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -61.32 -51.07 70.4 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.053 1.341 . . . . 0.0 112.229 170.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -60.71 -36.94 80.07 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.25 -0.906 . . . . 0.0 112.862 177.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.34 -49.16 72.95 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 8.2 p-90 -73.7 -35.59 65.15 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 170.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -56.63 -31.59 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 125.393 1.477 . . . . 0.0 112.229 175.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -57.6 -19.61 27.16 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 119.027 0.831 . . . . 0.0 112.906 176.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.7 -15.35 23.98 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.119 1.367 . . . . 0.0 113.727 174.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 48.7 mt . . . . . 0 N--CA 1.472 0.663 0 CA-C-N 118.924 0.784 . . . . 0.0 112.453 174.774 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 . . . . . 0 N--CA 1.47 0.56 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -61.61 -53.34 57.52 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.897 0.879 . . . . 0.0 112.869 176.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt -60.67 -32.29 71.5 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 118.997 -0.525 . . . . 0.0 111.82 175.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.34 -51.61 35.3 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.796 0.838 . . . . 0.0 111.15 178.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.8 ttmt -61.06 -48.1 83.29 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.214 0.461 . . . . 0.0 110.593 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.94 -51.82 68.06 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.578 1.151 . . . . 0.0 112.707 177.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.67 -43.75 90.01 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.782 1.174 . . . . 0.0 112.858 177.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -63.22 -50.45 70.19 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.656 0.782 . . . . 0.0 112.022 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.3 mt -57.1 -50.81 71.63 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.113 0.965 . . . . 0.0 111.171 176.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.42 -45.33 84.74 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.991 0.917 . . . . 0.0 112.283 175.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -59.04 -50.78 72.79 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-N 120.766 1.621 . . . . 0.0 111.781 177.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.28 75.81 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -56.63 -52.28 65.46 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.932 0.893 . . . . 0.0 110.699 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.45 -41.61 73.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.973 1.309 . . . . 0.0 113.224 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -57.83 -52.42 65.53 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.931 0.892 . . . . 0.0 112.255 173.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.57 -36.06 82.66 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 176.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 37.3 t -68.59 -27.83 37.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 126.321 1.848 . . . . 0.0 113.166 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.6 -29.29 37.0 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 175.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.6 pttt -105.89 0.43 25.89 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.187 1.795 . . . . 0.0 113.795 176.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 45.8 ttm -93.44 -80.55 0.38 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.127 1.771 . . . . 0.0 111.799 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.91 143.82 49.15 Favored Pre-proline 0 N--CA 1.48 1.041 0 C-N-CA 126.997 2.119 . . . . 0.0 112.655 -175.024 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -68.21 -49.83 0.88 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 123.666 2.91 . . . . 0.0 113.304 -178.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.43 -37.01 86.04 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.241 1.416 . . . . 0.0 113.04 176.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.4 -40.09 95.13 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 118.761 -0.638 . . . . 0.0 110.062 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 12.5 tppt? -55.76 -50.18 71.13 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.478 171.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 50.4 mmtt -54.96 -54.6 40.74 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.266 0.939 . . . . 0.0 110.727 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.38 -47.57 81.5 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -71.0 -38.93 72.67 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.107 0.963 . . . . 0.0 112.285 -177.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.25 -47.88 82.4 Favored 'General case' 0 N--CA 1.465 0.297 0 O-C-N 121.052 -1.03 . . . . 0.0 111.409 171.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -56.85 -43.7 81.41 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.757 0.708 . . . . 0.0 112.225 172.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 13.0 tp -62.44 -39.94 94.97 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.722 1.147 . . . . 0.0 113.018 172.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.5 t -70.67 -45.16 65.59 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.857 -1.152 . . . . 0.0 112.81 -177.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -41.93 79.71 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.6 0.76 . . . . 0.0 110.984 175.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.3 tt -70.85 -29.73 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 179.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.49 -34.83 71.34 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 . . . . . 0 CA--C 1.544 0.746 0 C-N-CA 124.399 1.08 . . . . 0.0 113.479 172.133 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 2.4 tp . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -46.64 -38.1 9.2 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.484 1.113 . . . . 0.0 113.092 173.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -62.52 -59.15 5.35 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.552 0.741 . . . . 0.0 112.039 171.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.5 -36.13 83.19 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.976 0.91 . . . . 0.0 112.815 -175.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -53.68 -54.65 34.9 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 126.636 1.974 . . . . 0.0 110.866 166.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.0 tttt -52.63 -52.09 57.08 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 117.686 -1.15 . . . . 0.0 110.597 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.9 mm -52.27 -50.96 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 119.44 1.018 . . . . 0.0 111.471 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -64.84 -42.57 94.8 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.1 0.864 . . . . 0.0 112.549 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.52 -36.13 83.22 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.887 1.275 . . . . 0.0 113.044 179.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.7 pp -78.13 -42.56 27.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 119.165 0.893 . . . . 0.0 111.856 170.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 58.6 t80 . . . . . 0 N--CA 1.473 0.725 0 C-N-CA 124.84 1.256 . . . . 0.0 113.187 179.149 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo . . . . . 0 CA--C 1.538 0.704 0 CA-C-O 121.498 0.541 . . . . 0.0 112.899 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -63.39 -20.49 65.59 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 175.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.2 p -65.42 -51.55 59.52 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.933 1.242 . . . . 0.0 112.21 176.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.2 p -72.56 -39.08 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.649 -0.657 . . . . 0.0 111.424 176.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 29.1 mtmt -57.87 -50.15 74.3 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.034 0.834 . . . . 0.0 111.8 173.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -65.88 -40.76 91.9 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.552 1.069 . . . . 0.0 113.551 177.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.22 -35.35 79.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.575 1.08 . . . . 0.0 112.873 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.46 -23.33 26.03 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.356 1.063 . . . . 0.0 113.418 178.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 . . . . . 0 N--CA 1.48 1.054 0 C-N-CA 126.609 1.964 . . . . 0.0 113.834 177.095 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo . . . . . 0 CA--C 1.547 1.158 0 CA-C-O 119.147 -0.439 . . . . 0.0 111.726 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.04 -21.43 27.61 Favored 'Trans proline' 0 CA--C 1.555 1.569 0 C-N-CA 122.523 2.149 . . . . 0.0 116.55 166.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.36 170.25 17.73 Favored 'Trans proline' 0 C--N 1.363 1.308 0 CA-C-N 124.18 2.529 . . . . 0.0 112.762 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -62.47 123.64 12.78 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.578 2.186 . . . . 0.0 110.846 173.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -52.87 -38.2 61.32 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 122.163 0.982 . . . . 0.0 111.868 169.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.82 22.42 1.13 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 128.709 2.804 . . . . 0.0 115.064 175.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -41.0 113.22 0.37 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.657 1.583 . . . . 0.0 113.44 175.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.94 23.28 0.19 Allowed Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.207 1.384 . . . . 0.0 114.742 -175.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -125.2 158.85 62.18 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 125.789 1.636 . . . . 0.0 112.347 -172.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.37 170.72 19.69 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.211 2.607 . . . . 0.0 113.106 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -52.45 -38.27 58.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.81 1.244 . . . . 0.0 113.277 -177.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -56.22 -40.2 73.7 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.623 1.569 . . . . 0.0 112.349 176.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 79.7 t -79.46 -39.55 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.963 1.305 . . . . 0.0 111.809 174.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 57.8 t -55.65 -38.94 52.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.0 0.92 . . . . 0.0 111.037 177.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -60.43 -50.63 72.81 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.799 -1.188 . . . . 0.0 112.221 174.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.67 -47.62 79.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.361 1.064 . . . . 0.0 111.616 177.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.63 -51.7 46.45 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.167 0.987 . . . . 0.0 111.671 168.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.54 -47.15 86.88 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 120.183 1.356 . . . . 0.0 113.287 -176.355 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -65.45 -34.18 77.68 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 122.545 0.338 . . . . 0.0 111.692 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.95 -54.63 14.32 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 173.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.26 -34.17 68.36 Favored 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 123.871 0.868 . . . . 0.0 112.517 -178.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -51.5 -30.54 20.51 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 171.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.8 tttt -74.91 -36.08 62.22 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.778 1.231 . . . . 0.0 113.145 173.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -102.64 15.08 30.32 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.499 1.52 . . . . 0.0 113.052 -177.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -63.36 -19.74 64.91 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.477 -1.39 . . . . 0.0 113.385 -172.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -100.4 1.04 40.99 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 126.947 2.099 . . . . 0.0 113.773 -178.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -79.38 177.73 8.63 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.786 1.635 . . . . 0.0 111.819 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.93 172.1 8.36 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.864 2.066 . . . . 0.0 111.938 177.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -49.56 -59.24 7.05 Favored Pre-proline 0 CA--C 1.546 0.793 0 C-N-CA 124.721 1.208 . . . . 0.0 113.107 175.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.21 -36.93 15.3 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.868 1.712 . . . . 0.0 112.607 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.74 -49.41 77.6 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.896 -1.127 . . . . 0.0 112.182 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.0 mt -61.94 -53.42 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-O 117.928 -1.034 . . . . 0.0 109.289 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -51.83 -44.87 63.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.301 1.41 . . . . 0.0 111.677 -176.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -51.13 68.34 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 125.108 1.363 . . . . 0.0 112.994 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.62 -39.14 92.87 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.106 0.562 . . . . 0.0 112.479 176.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -61.68 -50.18 73.52 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.518 1.127 . . . . 0.0 109.848 173.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -62.74 -28.38 69.93 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.34 -54.8 39.09 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.465 -0.772 . . . . 0.0 112.667 174.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 8.3 p-90 -73.84 -30.42 62.66 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 175.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.35 -29.67 46.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 120.623 -1.298 . . . . 0.0 112.667 175.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -58.95 -15.55 13.48 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.012 0.824 . . . . 0.0 113.147 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.9 p -115.07 -2.99 12.64 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.363 1.465 . . . . 0.0 113.56 177.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 9.7 mt . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 175.521 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 . . . . . 0 N--CA 1.473 0.717 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.0 ttt -64.01 -51.28 64.95 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.631 0.772 . . . . 0.0 112.424 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -52.93 -40.04 63.31 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 122.972 0.509 . . . . 0.0 111.86 172.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.14 -48.84 64.27 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.336 0.655 . . . . 0.0 111.244 -178.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -60.13 -53.08 62.03 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.046 0.938 . . . . 0.0 110.389 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -60.12 -50.46 73.6 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.569 1.147 . . . . 0.0 112.437 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.68 -47.33 86.08 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.261 0.937 . . . . 0.0 112.176 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.31 -45.12 85.64 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.252 -0.905 . . . . 0.0 112.823 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.4 mp -56.18 -47.64 77.9 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.735 0.814 . . . . 0.0 110.535 171.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.49 -47.18 84.93 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 117.678 -1.153 . . . . 0.0 111.933 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -56.18 -50.31 71.56 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 121.609 2.004 . . . . 0.0 113.376 175.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.07 -50.35 70.94 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.796 -0.565 . . . . 0.0 112.239 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 34.2 m170 -55.97 -41.13 74.28 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-O 117.694 -1.146 . . . . 0.0 111.354 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -51.03 71.71 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 126.182 1.793 . . . . 0.0 112.398 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -58.99 -47.16 86.15 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.3 176.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.1 -51.04 63.71 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 176.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 41.5 t -59.42 -28.56 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 126.976 2.11 . . . . 0.0 112.586 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.93 -28.57 24.12 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 173.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -101.73 -0.51 34.31 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.028 1.331 . . . . 0.0 114.354 176.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.1 mmt -88.23 -85.73 0.18 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.594 1.158 . . . . 0.0 110.775 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -129.7 155.22 80.71 Favored Pre-proline 0 N--CA 1.476 0.853 0 C-N-CA 127.039 2.135 . . . . 0.0 112.945 -176.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.5 -51.79 0.31 Allowed 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.76 2.973 . . . . 0.0 112.846 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -62.85 -34.18 76.82 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.463 1.505 . . . . 0.0 113.217 177.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -42.61 99.75 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 118.938 -0.553 . . . . 0.0 110.437 178.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.53 -45.85 77.11 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 117.909 -1.043 . . . . 0.0 110.951 171.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.4 mttt -58.08 -54.76 43.35 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.122 1.328 . . . . 0.0 111.839 177.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.62 -54.98 40.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.452 0.701 . . . . 0.0 112.498 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.68 -46.88 77.53 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.331 1.052 . . . . 0.0 112.758 175.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.84 -43.33 99.06 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.55 1.068 . . . . 0.0 111.502 -179.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.18 -46.91 82.42 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.082 0.953 . . . . 0.0 111.881 170.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.9 mp -63.53 -32.51 73.99 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 173.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.3 t -73.25 -41.45 63.67 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.783 1.233 . . . . 0.0 112.571 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -71.36 -44.36 65.17 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.485 -0.759 . . . . 0.0 111.023 176.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 15.8 tt -69.53 -30.07 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.06 -41.78 68.53 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.134 0.879 . . . . 0.0 112.388 176.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 . . . . . 0 CA--C 1.544 0.744 0 C-N-CA 124.858 1.263 . . . . 0.0 113.518 177.178 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.477 0.882 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.44 -37.68 39.39 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.417 1.087 . . . . 0.0 112.94 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.5 mtmt -60.32 -59.41 5.45 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.599 0.76 . . . . 0.0 111.135 173.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -62.88 -36.17 82.43 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.72 0.808 . . . . 0.0 112.916 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.7 -53.23 57.58 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.42 1.088 . . . . 0.0 110.802 170.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 50.6 tttt -55.04 -50.69 68.44 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.654 0.782 . . . . 0.0 111.66 175.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 23.5 mm -51.6 -48.75 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.688 1.195 . . . . 0.0 111.059 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -64.87 -42.58 94.73 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 120.17 1.35 . . . . 0.0 113.025 177.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.94 -40.96 99.22 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.856 0.863 . . . . 0.0 112.979 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -75.88 -35.39 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 121.378 -0.827 . . . . 0.0 111.782 172.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 47.7 t80 . . . . . 0 N--CA 1.469 0.508 0 C-N-CA 124.619 1.168 . . . . 0.0 112.889 179.491 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo . . . . . 0 CA--C 1.537 0.632 0 CA-C-O 121.824 0.677 . . . . 0.0 112.586 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -26.28 53.92 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 174.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.2 t -59.4 -51.65 68.98 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.629 1.104 . . . . 0.0 111.924 179.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.8 -49.19 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.706 -0.621 . . . . 0.0 109.759 173.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -58.42 -37.52 75.54 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.59 -171.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -67.85 -46.28 72.2 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.78 1.632 . . . . 0.0 113.675 170.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -59.43 -34.08 72.04 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.85 1.204 . . . . 0.0 112.959 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.4 pp -91.87 -20.86 21.0 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.784 1.234 . . . . 0.0 113.651 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.475 0.804 0 CA-C-N 119.745 1.157 . . . . 0.0 112.412 171.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 CA--C 1.546 1.076 0 CA-C-O 119.126 -0.448 . . . . 0.0 111.688 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -71.81 -22.09 24.06 Favored 'Trans proline' 0 CA--C 1.553 1.455 0 C-N-CA 122.102 1.868 . . . . 0.0 116.469 167.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.88 166.45 27.7 Favored 'Trans proline' 0 C--N 1.363 1.326 0 CA-C-N 124.332 2.583 . . . . 0.0 112.276 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.417 ' HA ' ' CZ ' ' A' ' 21' ' ' PHE . 40.2 Cg_endo -58.82 129.39 31.95 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.706 2.27 . . . . 0.0 110.843 171.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -48.68 -48.59 39.89 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 122.826 0.45 . . . . 0.0 111.296 172.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -83.33 29.29 0.5 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.508 1.923 . . . . 0.0 114.419 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -37.6 104.19 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.035 1.734 . . . . 0.0 114.919 -179.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 147.55 11.0 0.18 Allowed Glycine 0 CA--C 1.542 1.741 0 C-N-CA 125.626 1.584 . . . . 0.0 115.683 -173.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -109.54 159.26 32.18 Favored Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 125.745 1.618 . . . . 0.0 112.612 -172.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -73.98 169.55 22.14 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 123.019 2.479 . . . . 0.0 113.32 179.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -54.62 -38.09 66.39 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.656 1.183 . . . . 0.0 113.267 -177.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -53.39 -39.98 64.69 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.74 1.616 . . . . 0.0 112.486 174.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.2 t -82.08 -38.96 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 124.863 1.265 . . . . 0.0 112.077 176.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.7 t -56.71 -38.77 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 119.02 0.827 . . . . 0.0 111.337 176.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -62.65 -50.38 71.44 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.366 -0.834 . . . . 0.0 112.549 174.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.39 -47.76 75.35 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.083 0.953 . . . . 0.0 111.704 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 8' ' ' PRO . 15.5 t80 -51.18 -52.96 39.27 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.265 1.026 . . . . 0.0 111.897 168.493 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -47.4 85.72 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.02 0.827 . . . . 0.0 113.124 -177.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -65.18 -37.84 88.62 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.229 0.612 . . . . 0.0 111.772 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.2 tp -59.27 -52.24 66.49 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.063 0.545 . . . . 0.0 110.884 169.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.62 -29.11 70.37 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -179.246 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.9 mttm -54.15 -35.56 62.37 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.349 1.431 . . . . 0.0 112.9 172.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.57 -32.8 60.52 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.29 1.036 . . . . 0.0 113.118 175.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -97.69 16.65 19.95 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.166 1.786 . . . . 0.0 113.367 179.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.6 -17.05 64.3 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 119.787 -1.82 . . . . 0.0 113.867 -170.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.7 p -100.82 1.58 40.26 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 128.051 2.54 . . . . 0.0 113.771 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -79.72 165.48 22.78 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.921 1.688 . . . . 0.0 112.592 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.89 171.02 9.89 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.962 1.705 . . . . 0.0 111.97 176.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -47.91 -59.76 5.3 Favored Pre-proline 0 N--CA 1.474 0.732 0 C-N-CA 126.343 1.857 . . . . 0.0 113.078 174.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -65.16 -30.61 55.26 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 122.118 1.879 . . . . 0.0 113.43 179.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.44 -44.95 63.89 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.639 1.175 . . . . 0.0 111.963 -178.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 80.0 mt -66.57 -53.04 39.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.702 0.801 . . . . 0.0 109.647 172.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.95 -36.49 72.61 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 118.774 0.715 . . . . 0.0 111.837 -174.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -61.41 -60.44 3.71 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 125.382 1.473 . . . . 0.0 113.687 175.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -35.62 75.74 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -63.79 -51.0 66.77 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.501 1.121 . . . . 0.0 112.194 172.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -57.48 -36.71 71.84 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.022 0.828 . . . . 0.0 113.141 175.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.32 -51.1 67.81 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -178.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 6.9 p-90 -73.92 -32.51 63.57 Favored 'General case' 0 CA--C 1.553 1.093 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 170.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.72 -31.16 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 O-C-N 120.584 -1.323 . . . . 0.0 112.017 173.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -55.95 -24.14 36.34 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.065 0.848 . . . . 0.0 112.384 177.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.59 -16.99 26.27 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.031 1.333 . . . . 0.0 113.28 177.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 62.8 mt . . . . . 0 N--CA 1.473 0.718 0 CA-C-N 118.669 0.668 . . . . 0.0 112.485 174.559 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 ppp? -60.41 -51.76 68.09 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 176.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -56.39 -35.93 68.3 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.181 0.592 . . . . 0.0 112.478 175.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.01 -51.49 46.53 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.52 0.728 . . . . 0.0 111.155 178.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.4 tttt -60.39 -49.68 76.6 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.52 0.728 . . . . 0.0 111.001 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -61.59 -51.25 69.3 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.272 1.429 . . . . 0.0 112.506 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.94 -44.18 91.36 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.634 1.106 . . . . 0.0 112.525 176.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.81 -51.14 69.48 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.832 0.853 . . . . 0.0 111.792 177.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.6 mt -54.62 -51.16 66.23 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.261 1.024 . . . . 0.0 111.104 174.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.12 -44.38 87.72 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.214 1.006 . . . . 0.0 112.66 178.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.1 tttm -58.33 -50.66 72.85 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.81 1.244 . . . . 0.0 112.0 176.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.62 -46.42 88.35 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.644 0.778 . . . . 0.0 112.221 178.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.99 -51.33 70.1 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.817 0.847 . . . . 0.0 110.831 176.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -54.52 -46.49 73.53 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.979 1.312 . . . . 0.0 112.815 174.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -55.65 -50.1 71.13 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.669 0.788 . . . . 0.0 112.525 175.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -68.32 -30.86 69.94 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 176.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 63.3 t -72.93 -24.83 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 126.376 1.87 . . . . 0.0 113.42 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.67 -30.3 65.33 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 178.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.2 pttt -86.82 1.08 53.55 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.331 1.453 . . . . 0.0 114.492 173.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.6 ttm -103.88 -159.02 0.7 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.839 2.056 . . . . 0.0 111.568 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.47 156.63 21.75 Favored Pre-proline 0 N--CA 1.479 1.019 0 C-N-CA 125.424 1.49 . . . . 0.0 113.97 177.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.43 -46.6 1.29 Allowed 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 123.843 3.029 . . . . 0.0 113.141 -176.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -61.66 -32.12 72.27 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.784 1.233 . . . . 0.0 112.924 176.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.23 -46.98 86.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 122.751 0.42 . . . . 0.0 110.445 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -55.24 -43.55 74.68 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 118.367 -0.825 . . . . 0.0 111.103 174.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? -58.47 -53.17 61.33 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.681 1.128 . . . . 0.0 112.142 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.52 -44.71 95.75 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -73.13 -39.75 65.47 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.38 -47.66 84.82 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.835 0.854 . . . . 0.0 110.532 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -51.3 -51.66 52.24 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.057 0.943 . . . . 0.0 110.941 170.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -37.37 86.07 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.543 0.611 . . . . 0.0 112.446 -179.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.7 t -73.27 -43.59 60.77 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.199 -0.938 . . . . 0.0 112.885 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -46.52 73.72 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.367 0.667 . . . . 0.0 110.525 175.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.7 tp -66.65 -33.53 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 118.852 0.751 . . . . 0.0 112.018 -179.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.92 -31.81 72.96 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 177.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 . . . . . 0 N--CA 1.471 0.576 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 176.165 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.755 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -53.61 -35.07 60.49 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.553 -0.717 . . . . 0.0 112.499 -179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -56.91 -59.52 4.93 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.006 0.522 . . . . 0.0 111.254 171.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.38 -38.07 88.93 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.313 0.506 . . . . 0.0 112.066 -175.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.03 -51.4 57.7 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.951 1.3 . . . . 0.0 110.459 170.458 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -57.76 -48.52 79.41 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 118.348 -0.834 . . . . 0.0 112.108 175.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 35.2 mm -52.72 -52.03 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.686 1.194 . . . . 0.0 111.879 177.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 38.5 mm-40 -66.61 -38.67 87.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.145 1.338 . . . . 0.0 112.547 177.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.85 -37.24 81.42 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.574 0.75 . . . . 0.0 112.976 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -84.53 -30.05 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.3 1.04 . . . . 0.0 113.338 172.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 84.1 t80 . . . . . 0 N--CA 1.472 0.629 0 C-N-CA 124.447 1.099 . . . . 0.0 112.788 177.361 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo . . . . . 0 CA--C 1.536 0.603 0 CA-C-O 121.314 0.464 . . . . 0.0 112.157 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -58.76 -25.91 63.5 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 174.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.9 m -62.43 -51.63 66.78 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.865 1.211 . . . . 0.0 111.857 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 10.2 p -70.53 -39.91 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 121.931 -0.48 . . . . 0.0 111.406 175.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -59.19 -47.24 86.05 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.381 0.672 . . . . 0.0 111.243 178.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -68.78 -44.65 73.22 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.244 1.017 . . . . 0.0 112.642 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -63.94 -33.83 76.61 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.893 -1.13 . . . . 0.0 113.076 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.0 -24.06 23.64 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.958 0.903 . . . . 0.0 113.037 177.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 . . . . . 0 N--CA 1.482 1.143 0 C-N-CA 126.189 1.795 . . . . 0.0 113.554 179.712 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo . . . . . 0 CA--C 1.545 1.053 0 N-CA-C 110.989 -0.427 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.53 -23.21 37.45 Favored 'Trans proline' 0 CA--C 1.553 1.458 0 C-N-CA 122.765 2.31 . . . . 0.0 116.768 168.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.14 167.19 24.35 Favored 'Trans proline' 0 C--N 1.361 1.227 0 CA-C-N 124.141 2.515 . . . . 0.0 113.125 175.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.435 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 40.1 Cg_endo -61.4 120.83 8.69 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.117 2.545 . . . . 0.0 111.477 172.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -51.25 -33.76 29.53 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.088 0.955 . . . . 0.0 111.669 171.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.3 34.09 2.68 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 127.04 2.136 . . . . 0.0 113.702 178.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.49 110.67 0.24 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.016 1.326 . . . . 0.0 113.37 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 145.52 11.03 0.26 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.504 1.526 . . . . 0.0 115.24 -173.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.45 158.19 40.63 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.964 1.706 . . . . 0.0 112.575 -171.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.83 170.19 20.62 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 123.228 2.619 . . . . 0.0 112.962 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -54.82 -37.92 66.73 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.494 1.117 . . . . 0.0 113.545 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.45 -39.75 64.7 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.321 1.448 . . . . 0.0 112.512 173.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.5 t -80.69 -41.79 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 124.554 1.142 . . . . 0.0 112.095 175.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.1 t -55.79 -38.97 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 118.922 0.783 . . . . 0.0 111.249 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -60.62 -50.68 72.56 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.181 -0.95 . . . . 0.0 112.266 173.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.35 -47.13 76.2 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.208 1.003 . . . . 0.0 111.529 177.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.435 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -51.79 -53.79 35.95 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.677 1.191 . . . . 0.0 111.995 169.542 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -59.07 -47.51 84.99 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.681 1.128 . . . . 0.0 113.517 -178.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -68.09 -30.23 69.35 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.421 0.689 . . . . 0.0 112.298 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.7 tp -69.06 -45.36 70.57 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 121.556 -0.715 . . . . 0.0 111.646 168.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.16 -45.31 95.17 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.255 1.422 . . . . 0.0 113.943 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -24.52 54.59 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 119.36 0.982 . . . . 0.0 113.547 177.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -75.61 -36.48 60.25 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.535 1.934 . . . . 0.0 112.632 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -109.79 20.47 18.02 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.484 1.914 . . . . 0.0 112.798 178.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.9 -24.53 66.06 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.028 -1.67 . . . . 0.0 112.922 -174.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.67 -1.23 30.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.069 2.148 . . . . 0.0 113.797 178.357 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -89.75 171.7 9.45 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.745 1.618 . . . . 0.0 112.13 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.56 170.33 11.98 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 126.267 1.827 . . . . 0.0 112.041 175.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -45.45 -62.34 1.8 Allowed Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.501 1.52 . . . . 0.0 112.969 172.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.35 -35.26 24.43 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.034 1.823 . . . . 0.0 114.022 -179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -60.57 -44.96 95.59 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.116 -0.99 . . . . 0.0 112.234 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 61.6 mt -70.95 -47.75 60.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 118.74 -0.648 . . . . 0.0 111.162 175.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -52.38 -38.75 59.67 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.023 0.829 . . . . 0.0 110.902 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -51.0 71.21 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.671 1.588 . . . . 0.0 112.394 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.64 -38.49 89.51 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.162 0.585 . . . . 0.0 111.901 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -62.91 -51.09 68.29 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.459 1.103 . . . . 0.0 110.988 173.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -59.75 -34.0 72.39 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.283 1.033 . . . . 0.0 113.621 176.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.3 -52.24 66.42 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.717 -0.614 . . . . 0.0 112.57 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 10.7 p-90 -73.74 -29.85 62.47 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 172.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.64 -32.18 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 O-C-N 120.789 -1.194 . . . . 0.0 112.65 174.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -58.1 -17.82 20.76 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 175.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.57 -11.89 18.9 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.801 1.24 . . . . 0.0 113.385 177.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 19.9 mt . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 175.695 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -61.93 -53.27 58.06 Favored 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 123.737 0.815 . . . . 0.0 112.258 176.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -55.13 -36.15 65.45 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.122 0.569 . . . . 0.0 111.894 176.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.81 -51.51 40.02 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.008 0.923 . . . . 0.0 111.509 179.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.7 mttm -59.27 -49.39 78.01 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.338 1.055 . . . . 0.0 111.591 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.35 -54.11 50.54 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.259 1.423 . . . . 0.0 112.096 177.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.3 -44.63 96.9 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.572 1.078 . . . . 0.0 112.841 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -67.66 -45.45 75.25 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.616 -0.678 . . . . 0.0 112.389 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.49 -51.14 67.97 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.002 0.921 . . . . 0.0 110.565 170.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.02 -43.91 91.66 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.293 0.637 . . . . 0.0 112.247 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -56.74 -50.73 71.36 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.795 1.18 . . . . 0.0 112.161 174.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.12 -47.55 82.31 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.14 0.576 . . . . 0.0 112.194 179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -56.79 -49.93 73.85 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.919 1.288 . . . . 0.0 110.744 174.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -52.67 -48.6 66.41 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.92 1.688 . . . . 0.0 111.51 177.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -56.93 -49.5 75.45 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.895 1.278 . . . . 0.0 112.654 176.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.79 -30.84 71.54 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.923 1.082 . . . . 0.0 113.923 172.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 96.4 t -72.99 -24.43 20.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.967 1.307 . . . . 0.0 112.675 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.89 -28.73 62.24 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 176.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -89.82 1.41 56.19 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.156 1.382 . . . . 0.0 114.573 173.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.4 ttm -105.35 -161.62 0.82 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.795 2.038 . . . . 0.0 111.643 -172.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.9 155.66 22.43 Favored Pre-proline 0 N--CA 1.479 1.01 0 C-N-CA 124.622 1.169 . . . . 0.0 113.536 177.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.46 -42.6 3.56 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 123.387 2.725 . . . . 0.0 112.42 -178.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -63.55 -34.71 78.39 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.308 -0.87 . . . . 0.0 112.645 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.4 -41.28 93.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.744 0.818 . . . . 0.0 110.198 175.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.34 -48.05 74.78 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.89 174.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -59.4 -52.45 65.57 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.205 1.002 . . . . 0.0 111.629 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.9 -48.69 80.68 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 177.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -70.56 -42.4 71.19 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.447 -0.783 . . . . 0.0 112.512 -176.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.92 -43.4 98.92 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.083 -1.011 . . . . 0.0 112.2 173.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -54.92 -50.09 69.66 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.481 1.112 . . . . 0.0 111.471 171.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.4 tp -59.7 -37.74 79.69 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 173.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.6 t -73.23 -40.27 64.81 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.59 -1.319 . . . . 0.0 112.923 -177.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.5 ptpm? -69.21 -43.41 74.16 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.847 -0.597 . . . . 0.0 110.779 175.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.4 tt -70.03 -33.18 54.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 119.141 0.882 . . . . 0.0 112.341 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.71 69.48 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.289 1.036 . . . . 0.0 113.426 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.542 0.641 0 C-N-CA 125.303 1.441 . . . . 0.0 113.442 179.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.48 1.044 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.52 -35.3 39.97 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.692 0.797 . . . . 0.0 112.979 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -59.42 -59.36 5.58 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-O 118.967 -0.539 . . . . 0.0 111.588 171.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.16 -36.32 83.68 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.039 0.836 . . . . 0.0 112.707 -175.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.8 tm0? -51.72 -54.59 26.67 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.139 1.376 . . . . 0.0 110.791 167.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -57.52 -50.68 72.28 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 117.97 -1.014 . . . . 0.0 112.497 176.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 30.8 mm -52.17 -48.67 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.757 1.223 . . . . 0.0 111.556 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -67.51 -44.22 78.95 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.416 -0.803 . . . . 0.0 112.744 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.8 -37.84 83.34 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.084 0.953 . . . . 0.0 112.819 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -79.34 -34.24 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.021 0.928 . . . . 0.0 112.472 170.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 64.6 t80 . . . . . 0 N--CA 1.473 0.687 0 CA-C-N 119.957 1.253 . . . . 0.0 113.342 177.965 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo . . . . . 0 CA--C 1.533 0.458 0 CA-C-O 121.811 0.671 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -59.24 -24.88 63.56 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 12.7 t -63.0 -51.74 65.69 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.338 0.972 . . . . 0.0 111.875 175.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.7 p -72.89 -39.28 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 O-C-N 121.857 -0.527 . . . . 0.0 111.353 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -57.38 -50.18 73.81 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.11 0.868 . . . . 0.0 111.734 173.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -66.03 -43.43 87.6 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.934 1.243 . . . . 0.0 112.126 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -63.46 -33.63 75.99 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 120.57 -1.331 . . . . 0.0 113.067 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.22 -22.69 22.63 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.208 1.003 . . . . 0.0 113.151 178.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 . . . . . 0 N--CA 1.483 1.216 0 C-N-CA 126.865 2.066 . . . . 0.0 114.137 177.848 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo . . . . . 0 CA--C 1.545 1.055 0 CA-C-O 119.098 -0.459 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -70.44 -22.59 28.76 Favored 'Trans proline' 0 CA--C 1.554 1.478 0 C-N-CA 122.041 1.827 . . . . 0.0 116.279 166.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -70.19 167.75 24.09 Favored 'Trans proline' 0 C--N 1.363 1.3 0 CA-C-N 124.078 2.492 . . . . 0.0 112.913 179.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -61.37 126.77 20.07 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.934 2.423 . . . . 0.0 110.467 172.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -56.73 -43.43 80.65 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 122.062 -0.399 . . . . 0.0 110.644 173.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -72.59 16.09 0.16 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 126.778 2.031 . . . . 0.0 116.453 174.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.34 106.71 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.804 2.041 . . . . 0.0 114.724 -174.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.87 30.59 0.17 Allowed Glycine 0 CA--C 1.537 1.458 0 C-N-CA 124.885 1.231 . . . . 0.0 114.837 -172.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -124.72 157.5 65.71 Favored Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 125.487 1.515 . . . . 0.0 111.925 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -73.18 168.15 25.48 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.304 2.669 . . . . 0.0 112.858 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -52.9 -37.47 60.66 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.667 1.187 . . . . 0.0 113.224 -178.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -57.92 -37.97 75.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.13 1.372 . . . . 0.0 112.643 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 84.6 t -80.12 -40.37 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.116 1.366 . . . . 0.0 111.481 173.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 32.2 t -57.02 -37.31 54.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.493 0.717 . . . . 0.0 111.15 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.9 tppt? -59.26 -50.18 75.0 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 120.545 -1.347 . . . . 0.0 112.223 174.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.15 -46.92 87.12 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.434 0.693 . . . . 0.0 111.263 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -51.97 60.24 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.145 0.978 . . . . 0.0 112.154 170.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -59.56 -47.49 85.36 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.609 1.095 . . . . 0.0 112.789 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -63.92 -37.04 85.93 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.583 0.753 . . . . 0.0 111.932 177.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.7 tp -66.38 -43.92 84.59 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.406 0.682 . . . . 0.0 112.166 173.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.71 -49.1 69.72 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.927 1.291 . . . . 0.0 113.543 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.3 pttt -56.31 -30.75 62.94 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.234 0.925 . . . . 0.0 113.017 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -65.92 -40.65 91.62 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.739 2.016 . . . . 0.0 112.345 174.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -109.73 28.28 8.72 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.568 1.947 . . . . 0.0 112.671 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -66.62 -24.65 66.34 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 119.888 -1.757 . . . . 0.0 112.374 -175.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.7 p -80.22 4.24 18.19 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 127.729 2.411 . . . . 0.0 114.361 177.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -87.51 170.92 10.92 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.431 1.492 . . . . 0.0 112.167 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.82 172.17 8.51 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.851 2.061 . . . . 0.0 111.643 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -51.16 -58.65 9.75 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.063 1.345 . . . . 0.0 112.591 176.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -68.67 -32.04 24.79 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 121.436 1.424 . . . . 0.0 113.128 178.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -65.89 -46.76 77.18 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 121.03 -1.044 . . . . 0.0 112.547 178.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 90.3 mt -65.66 -53.43 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 123.216 0.606 . . . . 0.0 109.555 175.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.09 -36.68 77.93 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 118.122 0.419 . . . . 0.0 112.007 -173.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.4 tttm -57.06 -57.07 14.17 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 126.008 1.723 . . . . 0.0 112.695 171.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -60.82 -40.43 92.71 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 122.871 0.468 . . . . 0.0 111.835 -177.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -59.01 -51.11 71.47 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.12 0.968 . . . . 0.0 111.101 171.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -62.93 -31.76 72.91 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.29 -52.01 67.08 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.58 0.752 . . . . 0.0 112.372 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 10.6 p-90 -73.29 -30.97 63.77 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 172.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -31.76 46.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.072 1.349 . . . . 0.0 112.596 174.023 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -57.83 -21.41 42.23 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 118.717 0.689 . . . . 0.0 112.716 174.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.38 -16.99 22.97 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.35 1.06 . . . . 0.0 112.941 178.3 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 22.8 mt . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 178.004 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.9 tmm? -64.31 -51.74 61.97 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 123.982 0.913 . . . . 0.0 112.537 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 23.5 mttm -54.49 -34.99 62.63 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.22 -51.55 30.0 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.943 0.792 . . . . 0.0 111.722 178.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.8 -50.06 75.38 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.093 0.957 . . . . 0.0 110.832 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.07 -51.08 70.69 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.151 1.38 . . . . 0.0 112.133 178.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.8 -50.39 72.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 120.166 1.348 . . . . 0.0 112.555 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.67 -50.73 71.31 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.705 0.802 . . . . 0.0 112.475 178.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.1 tp -55.07 -49.65 71.11 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.213 1.405 . . . . 0.0 111.258 175.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.78 -44.16 97.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.825 1.25 . . . . 0.0 111.592 178.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.0 tttp -57.52 -50.22 73.8 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.773 1.17 . . . . 0.0 111.983 175.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.31 -49.7 74.59 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.662 0.785 . . . . 0.0 112.751 176.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.4 m80 -54.76 -50.84 67.44 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.635 0.774 . . . . 0.0 111.572 173.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -53.7 -47.92 70.04 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.836 1.654 . . . . 0.0 112.887 176.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.17 -48.43 73.77 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.014 0.926 . . . . 0.0 112.122 174.113 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.04 77.78 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 50.3 t -69.6 -26.03 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 126.167 1.787 . . . . 0.0 112.365 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.22 -31.78 44.92 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 173.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.3 pttt -93.2 -1.19 56.49 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 176.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -90.85 -81.37 0.31 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.425 1.09 . . . . 0.0 110.711 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.64 153.71 80.79 Favored Pre-proline 0 N--CA 1.481 1.078 0 C-N-CA 126.96 2.104 . . . . 0.0 113.273 -173.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.59 -48.24 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.828 3.018 . . . . 0.0 113.191 -178.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -66.73 -34.41 77.77 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.284 1.034 . . . . 0.0 112.389 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.71 -34.62 78.62 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.568 0.747 . . . . 0.0 111.921 178.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.33 -53.31 52.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 118.996 0.816 . . . . 0.0 109.837 170.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.1 mttt -59.84 -47.39 85.91 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.358 0.663 . . . . 0.0 111.053 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.63 -54.46 46.22 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.431 1.092 . . . . 0.0 113.43 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.41 -35.73 79.86 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.2 -0.937 . . . . 0.0 112.488 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.45 -45.78 71.57 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 121.473 -0.767 . . . . 0.0 110.941 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -52.62 -51.96 57.63 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.193 0.997 . . . . 0.0 111.261 168.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 7.0 tp -58.65 -37.18 75.41 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 119.286 0.948 . . . . 0.0 112.042 177.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.7 t -70.18 -48.23 58.11 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.066 -1.021 . . . . 0.0 112.581 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 ptpt -69.5 -36.28 76.33 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.789 0.836 . . . . 0.0 111.671 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.2 tp -72.34 -32.04 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 118.629 0.649 . . . . 0.0 111.77 176.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.27 -21.54 65.29 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 -177.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.886 0 C-N-CA 125.708 1.603 . . . . 0.0 113.236 176.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.041 0 CA-C-O 121.775 0.797 . . . . 0.0 112.884 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.91 -35.35 6.36 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.35 1.06 . . . . 0.0 112.738 174.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.8 pttt -57.35 -53.48 57.63 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.356 1.462 . . . . 0.0 112.494 171.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.03 -33.77 74.15 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 120.294 1.406 . . . . 0.0 111.895 -179.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -59.09 -54.7 44.07 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 173.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.0 pttm -59.38 -42.77 92.45 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.529 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.5 mm -55.72 -48.52 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.325 1.05 . . . . 0.0 111.256 175.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -62.3 -45.35 93.66 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.237 1.381 . . . . 0.0 112.609 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.22 -35.47 81.16 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.584 0.754 . . . . 0.0 112.525 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.3 pt -79.31 -36.29 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 118.737 0.699 . . . . 0.0 112.208 170.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 55.6 t80 . . . . . 0 N--CA 1.473 0.701 0 C-N-CA 125.278 1.431 . . . . 0.0 112.024 179.281 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo . . . . . 0 CA--C 1.534 0.481 0 CA-C-O 121.093 0.372 . . . . 0.0 111.688 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -58.47 -25.54 62.39 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.608 -0.682 . . . . 0.0 112.801 175.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.7 m -61.56 -51.61 67.87 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.38 1.445 . . . . 0.0 112.197 177.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 9.4 p -75.3 -38.77 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.752 -0.593 . . . . 0.0 111.793 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -57.69 -48.33 79.83 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 118.911 0.778 . . . . 0.0 111.999 172.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.68 -39.55 73.47 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.511 1.05 . . . . 0.0 112.806 178.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -66.31 -34.81 78.83 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.675 1.125 . . . . 0.0 112.442 177.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.65 -21.55 25.22 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.108 0.963 . . . . 0.0 113.219 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 . . . . . 0 N--CA 1.48 1.051 0 C-N-CA 125.657 1.583 . . . . 0.0 113.864 179.184 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo . . . . . 0 CA--C 1.543 0.975 0 CA-C-O 119.165 -0.431 . . . . 0.0 111.731 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.25 -21.98 26.13 Favored 'Trans proline' 0 CA--C 1.554 1.478 0 C-N-CA 122.171 1.914 . . . . 0.0 116.5 167.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -70.28 166.53 27.92 Favored 'Trans proline' 0 C--N 1.362 1.268 0 CA-C-N 124.25 2.554 . . . . 0.0 112.873 178.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.31 126.86 19.49 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.814 2.343 . . . . 0.0 110.418 173.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -60.31 -33.81 72.9 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 119.807 -0.757 . . . . 0.0 111.419 174.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -77.91 17.26 0.6 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.33 2.252 . . . . 0.0 115.902 172.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -38.49 105.37 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.029 1.731 . . . . 0.0 114.922 -173.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 147.69 24.17 0.08 OUTLIER Glycine 0 CA--C 1.539 1.581 0 C-N-CA 124.864 1.221 . . . . 0.0 115.296 -172.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.96 158.97 46.53 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 125.098 1.359 . . . . 0.0 112.542 -173.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -73.46 167.29 27.67 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.196 2.598 . . . . 0.0 112.755 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -50.99 -40.7 58.57 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.503 1.521 . . . . 0.0 113.264 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -56.93 -37.48 71.55 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.48 1.512 . . . . 0.0 113.058 176.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.0 t -81.77 -41.11 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 125.0 1.32 . . . . 0.0 111.634 174.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 39.6 t -57.5 -36.94 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 123.956 0.902 . . . . 0.0 111.34 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.5 tptt -64.03 -43.22 96.26 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 172.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.77 -45.42 94.4 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.347 0.659 . . . . 0.0 110.54 175.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.76 -46.29 84.75 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-O 117.475 -1.25 . . . . 0.0 113.646 171.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.56 -47.02 83.26 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 120.192 1.36 . . . . 0.0 112.739 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.34 -38.25 88.78 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.02 0.928 . . . . 0.0 111.621 177.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.0 tp -63.89 -46.97 82.5 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 122.898 0.479 . . . . 0.0 111.46 171.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.44 -45.76 92.5 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.117 1.367 . . . . 0.0 114.443 -178.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -58.41 -28.26 65.05 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.664 1.12 . . . . 0.0 113.608 175.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -76.28 -32.61 58.9 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.503 1.521 . . . . 0.0 113.59 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -108.08 19.6 19.77 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.368 1.467 . . . . 0.0 114.197 176.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -57.79 -28.79 64.32 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 119.948 -1.72 . . . . 0.0 113.247 -177.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.7 m -77.18 -2.27 33.62 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.379 1.872 . . . . 0.0 113.767 179.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -83.21 167.28 17.85 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.381 1.472 . . . . 0.0 112.613 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.0 172.78 9.31 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 126.556 1.942 . . . . 0.0 112.213 177.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -50.77 -59.89 6.55 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 126.159 1.784 . . . . 0.0 112.913 175.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.8 -32.65 29.17 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.636 1.558 . . . . 0.0 112.974 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.65 -49.98 71.09 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.05 -1.032 . . . . 0.0 112.517 177.183 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 94.1 mt -61.93 -53.53 46.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 123.215 0.606 . . . . 0.0 110.228 174.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -58.52 -40.36 82.7 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 118.319 0.509 . . . . 0.0 112.342 -174.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.31 -54.22 49.22 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.412 1.885 . . . . 0.0 112.479 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.96 -41.12 97.63 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -59.36 -51.07 71.48 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 124.007 0.923 . . . . 0.0 113.033 171.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.61 -36.06 79.65 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 176.264 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.52 -50.33 73.42 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.159 0.89 . . . . 0.0 112.231 -177.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . 0.268 8.5 p-90 -69.24 -36.99 77.74 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 170.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.2 -31.19 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 125.109 1.364 . . . . 0.0 113.62 176.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -57.24 -17.66 12.6 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 175.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.35 -15.47 20.71 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.178 1.391 . . . . 0.0 113.689 176.058 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 32.6 mt . . . . . 0 N--CA 1.474 0.76 0 CA-C-N 118.899 0.772 . . . . 0.0 112.869 175.621 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.471 0.61 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -65.03 -51.57 60.82 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.608 1.163 . . . . 0.0 112.348 177.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 22.0 mtmt -54.97 -34.06 62.98 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.994 0.815 . . . . 0.0 112.668 172.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.39 -48.31 50.7 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 119.693 1.133 . . . . 0.0 111.767 178.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.45 -52.27 65.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.013 0.925 . . . . 0.0 110.66 177.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.01 -49.89 76.18 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.873 1.269 . . . . 0.0 112.259 178.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.1 -45.45 94.65 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.339 0.972 . . . . 0.0 112.014 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -63.43 -49.78 72.36 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 118.762 0.71 . . . . 0.0 111.674 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.8 mt -56.27 -50.02 72.55 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.045 1.338 . . . . 0.0 111.36 174.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -64.08 -41.68 97.22 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 118.569 -0.729 . . . . 0.0 112.249 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -59.2 -50.61 73.35 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.792 1.178 . . . . 0.0 111.719 176.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.79 -50.07 73.82 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.119 0.967 . . . . 0.0 113.091 175.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -57.05 -52.31 65.78 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 118.716 -0.659 . . . . 0.0 111.515 174.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.477 ' HG2' ' HZ1' ' A' ' 85' ' ' LYS . 5.9 tt0 -55.12 -44.16 74.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.537 1.535 . . . . 0.0 112.908 177.06 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.59 -52.32 64.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.246 1.019 . . . . 0.0 112.709 172.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.2 -33.34 75.17 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.534 0.606 . . . . 0.0 112.505 177.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 56.0 t -72.65 -25.46 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.242 1.817 . . . . 0.0 112.301 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.45 -33.02 58.78 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 175.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.4 pttt -90.25 -0.69 57.74 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.511 1.524 . . . . 0.0 114.289 173.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 tpp -95.26 -159.22 0.7 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.612 1.965 . . . . 0.0 111.89 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.38 156.84 20.09 Favored Pre-proline 0 N--CA 1.478 0.953 0 C-N-CA 126.313 1.845 . . . . 0.0 114.334 176.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -71.75 -43.04 1.42 Allowed 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.85 3.034 . . . . 0.0 113.537 -175.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -58.98 -36.59 75.13 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.668 1.187 . . . . 0.0 111.765 174.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.86 -42.47 90.38 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.488 0.715 . . . . 0.0 110.321 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.477 ' HZ1' ' HG2' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -53.91 -46.45 71.44 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.302 1.041 . . . . 0.0 111.799 173.84 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -62.97 -51.95 64.88 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.509 1.123 . . . . 0.0 112.083 178.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.07 -55.66 30.22 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.47 0.708 . . . . 0.0 112.02 176.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.75 -31.17 71.64 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.98 77.1 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.751 1.16 . . . . 0.0 111.275 171.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -42.59 94.63 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 174.428 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.97 -39.41 94.06 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 118.979 0.808 . . . . 0.0 113.121 174.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.0 t -71.6 -39.59 70.42 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 120.952 -1.092 . . . . 0.0 111.856 -177.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.04 -37.57 64.26 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 118.831 -0.604 . . . . 0.0 112.17 176.478 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.4 tt -72.99 -32.25 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 119.133 0.879 . . . . 0.0 112.972 177.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.78 -22.69 64.35 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 . . . . . 0 CA--C 1.551 1.017 0 C-N-CA 125.142 1.377 . . . . 0.0 113.613 173.268 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.471 0.59 0 CA-C-O 121.044 0.449 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -55.66 -37.62 68.5 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.775 1.23 . . . . 0.0 113.009 -174.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -61.25 -58.7 7.23 Favored 'General case' 0 C--N 1.346 0.45 0 C-N-CA 124.627 1.171 . . . . 0.0 112.428 170.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.96 77.62 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.057 1.343 . . . . 0.0 113.312 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -56.6 -52.19 65.8 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.091 1.356 . . . . 0.0 111.527 168.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.88 -48.04 64.26 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 118.791 -0.624 . . . . 0.0 111.675 173.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.1 mm -58.31 -52.22 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 118.849 0.749 . . . . 0.0 111.407 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -63.57 -36.98 85.58 Favored 'General case' 0 C--O 1.242 0.683 0 O-C-N 121.501 -0.749 . . . . 0.0 112.782 178.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.64 -41.54 83.69 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.312 -1.328 . . . . 0.0 113.016 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.4 pt -75.14 -33.31 28.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 O-C-N 121.464 -0.773 . . . . 0.0 110.95 177.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.3 t80 . . . . . 0 CA--C 1.534 0.33 0 O-C-N 121.235 -0.915 . . . . 0.0 111.598 176.675 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo . . . . . 0 CA--C 1.535 0.558 0 CA-C-O 121.975 0.74 . . . . 0.0 112.608 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -22.04 66.86 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.539 -0.726 . . . . 0.0 112.523 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 49.9 m -64.91 -48.62 73.51 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 173.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.1 p -74.88 -37.16 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 119.002 0.819 . . . . 0.0 110.485 177.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -57.6 -50.41 73.22 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.963 0.801 . . . . 0.0 111.991 171.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -63.23 -44.0 96.51 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.49 1.041 . . . . 0.0 112.996 178.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -66.59 -32.83 74.41 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.482 -0.761 . . . . 0.0 112.714 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.92 -22.79 21.81 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.192 0.997 . . . . 0.0 113.682 178.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 . . . . . 0 N--CA 1.475 0.8 0 C-N-CA 125.719 1.608 . . . . 0.0 111.953 176.245 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo . . . . . 0 CA--C 1.545 1.035 0 CA-C-O 119.118 -0.451 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -70.39 -23.47 27.89 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 CA-C-O 115.292 -2.045 . . . . 0.0 115.927 164.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -72.3 167.72 26.14 Favored 'Trans proline' 0 C--N 1.362 1.282 0 CA-C-N 124.596 2.677 . . . . 0.0 113.017 179.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -63.35 127.2 19.42 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.991 2.461 . . . . 0.0 112.053 177.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -62.32 -14.78 43.03 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 172.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.96 36.01 4.61 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 129.029 2.932 . . . . 0.0 112.409 177.236 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.89 109.82 0.19 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.682 1.593 . . . . 0.0 113.123 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.23 -19.4 1.37 Allowed Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.749 1.643 . . . . 0.0 114.069 -176.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.9 160.9 81.37 Favored Pre-proline 0 CA--C 1.558 1.276 0 C-N-CA 125.646 1.578 . . . . 0.0 113.753 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -75.68 171.54 18.0 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.921 3.081 . . . . 0.0 113.669 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -53.38 -35.17 60.04 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.619 1.168 . . . . 0.0 113.944 -178.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -54.35 -42.1 69.87 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.51 1.524 . . . . 0.0 112.068 174.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -77.81 -43.0 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 125.355 1.462 . . . . 0.0 112.099 173.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 88.3 t -55.29 -36.82 41.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 118.806 0.73 . . . . 0.0 111.352 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.7 tptm -62.96 -50.49 70.58 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.987 -1.071 . . . . 0.0 112.24 172.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.03 -48.34 73.54 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.467 0.707 . . . . 0.0 111.798 177.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -53.58 -52.42 59.81 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.738 1.215 . . . . 0.0 112.149 171.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -60.04 -47.51 85.56 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.571 1.078 . . . . 0.0 113.076 -179.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -63.71 -36.34 83.55 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.676 0.79 . . . . 0.0 111.732 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.7 tp -66.25 -46.06 78.41 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.372 0.669 . . . . 0.0 111.829 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -63.49 -45.97 88.29 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.843 1.257 . . . . 0.0 114.024 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -33.53 70.92 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 120.048 1.295 . . . . 0.0 113.461 177.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -69.1 -33.41 73.46 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.396 1.878 . . . . 0.0 112.95 173.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -107.04 20.34 19.17 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.019 2.128 . . . . 0.0 112.895 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -64.4 -25.51 68.05 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 119.775 -1.828 . . . . 0.0 112.762 -174.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.3 -5.01 59.0 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 127.142 2.177 . . . . 0.0 113.335 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.2 mmtt -76.09 -177.71 4.07 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.332 1.453 . . . . 0.0 112.906 178.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.77 172.77 6.67 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 128.082 2.553 . . . . 0.0 111.705 -177.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -49.96 -59.83 6.23 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 125.28 1.432 . . . . 0.0 112.426 176.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.45 -32.91 18.89 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 121.613 1.542 . . . . 0.0 113.261 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.48 -48.06 81.25 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.063 -1.023 . . . . 0.0 111.955 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 54.2 mt -66.1 -52.27 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.278 0.631 . . . . 0.0 110.02 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -57.08 -41.12 78.26 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.69 0.677 . . . . 0.0 111.814 -177.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -52.35 65.98 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.294 1.438 . . . . 0.0 112.917 174.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -62.25 -42.47 99.35 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -60.1 -49.73 76.49 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.295 1.038 . . . . 0.0 110.979 173.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.8 -35.44 76.5 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 176.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.73 -49.36 76.81 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.447 -0.783 . . . . 0.0 112.339 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 9.9 p-90 -73.17 -32.94 65.15 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 172.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.39 -30.68 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 125.507 1.523 . . . . 0.0 112.987 174.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.84 -19.28 16.57 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 118.803 0.729 . . . . 0.0 112.907 174.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.27 -18.54 22.36 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.799 1.24 . . . . 0.0 113.795 175.178 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 33.0 mt . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 178.236 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.76 -51.5 66.9 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.653 1.181 . . . . 0.0 111.905 177.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.5 mtmm -57.86 -33.6 68.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.46 -50.15 34.44 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.037 0.835 . . . . 0.0 111.444 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 tttm -57.15 -49.73 75.02 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.654 0.782 . . . . 0.0 110.396 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -62.19 -52.0 65.53 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.72 1.208 . . . . 0.0 112.23 179.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.66 -46.27 90.47 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.803 1.183 . . . . 0.0 112.859 178.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -61.75 -50.16 73.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.527 1.131 . . . . 0.0 111.398 178.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tt -56.7 -51.16 69.86 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.467 1.107 . . . . 0.0 110.685 174.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.38 -40.86 97.85 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.982 -178.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.1 tttt -59.01 -50.86 72.5 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.384 0.993 . . . . 0.0 111.379 173.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.33 -44.87 86.43 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.268 0.556 . . . . 0.0 111.548 -176.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -60.53 -49.36 77.86 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.798 1.239 . . . . 0.0 110.94 175.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.03 -43.21 86.65 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.647 1.112 . . . . 0.0 112.843 175.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -55.14 -52.57 62.86 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.43 1.092 . . . . 0.0 112.445 173.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.51 -31.27 71.89 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 175.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.4 t -73.05 -23.76 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.678 1.591 . . . . 0.0 113.382 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.63 -30.77 67.54 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.695 1.369 . . . . 0.0 114.695 177.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -86.09 -2.65 58.52 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.516 1.526 . . . . 0.0 114.219 172.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.9 tpp -96.86 -160.41 0.8 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.407 1.883 . . . . 0.0 111.833 -174.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.89 156.64 18.14 Favored Pre-proline 0 N--CA 1.478 0.971 0 C-N-CA 126.735 2.014 . . . . 0.0 113.984 174.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.79 -48.32 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 123.599 2.866 . . . . 0.0 112.858 -176.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -57.13 -32.96 66.89 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.034 1.334 . . . . 0.0 112.269 177.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.22 -48.79 74.49 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.474 0.709 . . . . 0.0 110.596 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -54.87 -45.5 74.62 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.713 0.688 . . . . 0.0 111.235 173.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? -54.99 -54.91 36.86 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 118.867 0.758 . . . . 0.0 111.241 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.54 -51.93 67.74 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.956 0.903 . . . . 0.0 113.15 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.4 -40.5 95.93 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -178.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.19 -45.11 94.84 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.481 0.712 . . . . 0.0 110.93 174.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -43.88 90.67 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.399 0.545 . . . . 0.0 112.374 172.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.63 -36.96 84.5 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 174.439 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 10.3 t -70.67 -42.41 70.77 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.406 1.082 . . . . 0.0 112.987 -178.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -70.5 -44.01 68.51 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.521 -0.737 . . . . 0.0 111.133 175.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.8 tt -68.26 -30.63 48.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 118.697 0.681 . . . . 0.0 112.371 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.06 -33.69 69.31 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 176.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 . . . . . 0 CA--C 1.542 0.648 0 C-N-CA 124.087 0.955 . . . . 0.0 113.412 173.291 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -44.94 -38.45 4.69 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.761 1.224 . . . . 0.0 112.994 172.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -63.99 -59.38 4.56 Favored 'General case' 0 C--N 1.345 0.394 0 C-N-CA 123.571 0.748 . . . . 0.0 111.031 174.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -63.16 -33.32 75.22 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.994 0.816 . . . . 0.0 113.071 -178.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.74 -53.73 53.04 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.688 1.595 . . . . 0.0 110.805 168.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -58.12 -48.12 81.19 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.044 0.937 . . . . 0.0 112.527 175.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 26.9 mm -54.05 -52.05 40.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.666 0.786 . . . . 0.0 110.562 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -66.62 -40.97 89.01 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 118.688 -0.672 . . . . 0.0 112.392 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.82 -40.36 94.99 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.566 1.075 . . . . 0.0 111.122 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 53.3 mt -75.86 -51.76 19.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 C-N-CA 123.983 0.913 . . . . 0.0 110.978 176.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.7 t80 . . . . . 0 N--CA 1.47 0.568 0 CA-C-N 118.879 0.763 . . . . 0.0 112.726 179.4 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo . . . . . 0 CA--C 1.537 0.643 0 CA-C-O 121.966 0.736 . . . . 0.0 113.01 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.04 -24.49 67.73 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.242 -0.911 . . . . 0.0 112.784 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.5 m -60.94 -51.54 68.85 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.248 0.931 . . . . 0.0 112.145 173.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.57 -37.34 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-N 118.529 0.604 . . . . 0.0 111.573 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.2 mtmp? -58.01 -49.89 75.31 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.794 -0.622 . . . . 0.0 111.972 172.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -64.33 -45.08 89.42 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.091 0.86 . . . . 0.0 112.891 177.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -65.63 -32.03 73.38 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.692 0.678 . . . . 0.0 112.744 -179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.19 -21.57 21.07 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 178.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 . . . . . 0 N--CA 1.475 0.784 0 C-N-CA 124.875 1.27 . . . . 0.0 112.521 179.238 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo . . . . . 0 CA--C 1.548 1.193 0 CA-C-O 118.965 -0.514 . . . . 0.0 111.663 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -71.65 -19.78 27.51 Favored 'Trans proline' 0 CA--C 1.554 1.486 0 C-N-CA 122.099 1.866 . . . . 0.0 116.11 164.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.48 169.43 20.93 Favored 'Trans proline' 0 C--N 1.362 1.281 0 CA-C-N 124.272 2.561 . . . . 0.0 112.729 177.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -60.1 122.31 11.18 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.858 2.372 . . . . 0.0 110.75 171.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -53.4 -32.62 50.38 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.054 0.542 . . . . 0.0 111.949 172.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.12 38.9 1.66 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 128.312 2.645 . . . . 0.0 113.138 176.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.72 112.92 0.48 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.808 1.243 . . . . 0.0 113.296 176.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.5 11.06 0.32 Allowed Glycine 0 CA--C 1.538 1.474 0 C-N-CA 125.296 1.427 . . . . 0.0 115.634 -176.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -111.27 159.8 31.55 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 125.645 1.578 . . . . 0.0 112.846 -171.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -73.53 169.74 21.6 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.298 2.665 . . . . 0.0 113.085 178.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -52.53 -35.19 52.83 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.553 1.141 . . . . 0.0 113.659 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -56.38 -39.07 72.34 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.205 1.402 . . . . 0.0 112.802 174.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.5 t -77.91 -44.83 28.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.595 1.158 . . . . 0.0 111.792 171.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 94.2 t -54.22 -37.53 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 123.366 0.667 . . . . 0.0 111.468 -178.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.7 tppt? -59.91 -50.57 73.25 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.363 -0.836 . . . . 0.0 112.376 174.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.95 -47.97 83.17 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.044 0.938 . . . . 0.0 111.728 177.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -53.79 -53.67 49.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.665 0.786 . . . . 0.0 111.433 172.609 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -63.19 -45.1 93.31 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.445 1.02 . . . . 0.0 113.138 -179.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -59.74 -39.17 83.88 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.231 1.013 . . . . 0.0 111.555 177.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.9 tp -68.31 -45.8 71.99 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.148 0.579 . . . . 0.0 111.577 172.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -45.73 87.0 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -56.88 -31.62 65.03 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 119.649 1.113 . . . . 0.0 112.431 178.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -73.65 -29.34 62.27 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.025 1.33 . . . . 0.0 111.744 175.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -109.81 23.7 14.03 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.045 1.738 . . . . 0.0 112.549 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -22.09 66.57 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 119.904 -1.747 . . . . 0.0 113.687 -175.502 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.0 p -92.88 4.11 54.48 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 128.803 2.841 . . . . 0.0 114.307 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -85.75 179.9 6.97 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.329 1.452 . . . . 0.0 111.858 178.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.22 171.27 7.71 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.284 2.234 . . . . 0.0 111.562 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -52.13 -57.62 14.51 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 124.625 1.17 . . . . 0.0 112.338 176.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.9 -33.19 27.16 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.516 1.477 . . . . 0.0 113.319 178.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.23 -47.14 80.83 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.166 -0.959 . . . . 0.0 112.603 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.4 mt -68.44 -53.28 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.089 0.556 . . . . 0.0 109.651 175.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -56.93 -35.84 69.52 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 119.023 -0.513 . . . . 0.0 112.068 -175.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 34.7 tttt -56.97 -58.32 8.66 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.194 1.798 . . . . 0.0 113.434 172.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -59.06 -40.06 84.0 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 122.962 0.505 . . . . 0.0 111.084 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -60.26 -50.33 74.08 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.369 1.068 . . . . 0.0 111.253 173.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.56 -33.25 71.19 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.62 -51.86 68.14 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.603 -0.686 . . . . 0.0 112.213 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 13.4 p-90 -73.8 -30.77 62.92 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 172.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.11 -32.15 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 O-C-N 120.781 -1.2 . . . . 0.0 112.677 174.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -58.0 -19.24 29.46 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 118.565 0.62 . . . . 0.0 112.268 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.89 -14.89 21.49 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.878 1.271 . . . . 0.0 113.222 177.273 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 22.8 mt . . . . . 0 N--CA 1.474 0.744 0 CA-C-N 118.99 0.814 . . . . 0.0 112.528 175.551 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -63.98 -51.9 62.15 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 124.183 0.993 . . . . 0.0 112.298 178.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -52.83 -39.12 62.2 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.329 173.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.08 -51.42 54.67 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.023 0.829 . . . . 0.0 111.885 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.4 mttm -58.87 -51.67 69.01 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.013 0.925 . . . . 0.0 111.272 175.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.22 -52.63 64.78 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.809 1.244 . . . . 0.0 111.963 177.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.83 -52.75 63.87 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.827 1.194 . . . . 0.0 112.863 178.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -62.85 -48.99 76.64 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.323 0.649 . . . . 0.0 112.314 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tp -54.84 -49.66 70.52 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.964 1.306 . . . . 0.0 111.171 174.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.22 -43.6 98.62 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.515 1.126 . . . . 0.0 111.729 178.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -58.25 -50.76 72.42 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.588 1.085 . . . . 0.0 111.954 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.96 -48.5 78.63 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.539 1.136 . . . . 0.0 112.633 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -57.3 -54.24 49.08 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.879 0.872 . . . . 0.0 110.979 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -40.99 72.87 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.998 1.319 . . . . 0.0 113.041 177.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.02 -52.63 64.71 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.479 0.712 . . . . 0.0 112.424 172.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.04 -31.49 72.05 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 176.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 62.8 t -73.04 -23.84 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 126.016 1.726 . . . . 0.0 112.63 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.78 -32.66 63.66 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.684 -1.26 . . . . 0.0 114.159 176.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -87.92 0.45 55.85 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.527 1.531 . . . . 0.0 114.551 174.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.3 mmt -94.57 -159.82 0.73 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.734 1.614 . . . . 0.0 111.254 -178.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.8 156.43 6.66 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.209 2.203 . . . . 0.0 114.038 173.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -69.38 -45.49 1.77 Allowed 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 123.692 2.928 . . . . 0.0 112.726 -176.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -59.67 -31.32 69.44 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.143 0.977 . . . . 0.0 112.223 176.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -66.03 -49.23 68.46 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.191 0.596 . . . . 0.0 110.283 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.02 -46.88 61.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.891 0.877 . . . . 0.0 110.714 172.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -58.93 -54.91 41.85 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.734 0.814 . . . . 0.0 111.162 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.69 -47.84 84.47 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.541 0.736 . . . . 0.0 112.75 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.85 -40.05 83.73 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.08 -45.74 92.19 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 119.455 1.025 . . . . 0.0 110.742 174.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.62 -44.05 89.86 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.117 0.967 . . . . 0.0 112.219 173.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.8 tp -63.96 -36.66 84.71 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 121.576 -0.703 . . . . 0.0 112.539 171.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.7 t -72.28 -39.35 68.39 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 120.357 -1.464 . . . . 0.0 112.899 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -71.16 -43.51 67.36 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.732 0.813 . . . . 0.0 110.989 175.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 7.3 tt -70.17 -32.13 49.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 118.588 0.631 . . . . 0.0 112.446 178.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.18 -30.21 64.32 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 CA--C 1.549 0.927 0 C-N-CA 125.256 1.422 . . . . 0.0 114.526 177.572 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.07 -38.98 8.63 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.688 1.595 . . . . 0.0 113.101 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.78 -59.5 5.33 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.314 173.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -63.74 -33.69 76.22 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.735 0.698 . . . . 0.0 111.7 -176.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -60.14 -47.91 83.93 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.288 1.035 . . . . 0.0 111.817 173.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -46.35 91.08 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 118.403 -0.808 . . . . 0.0 111.665 174.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 24.9 mm -53.19 -49.81 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 125.123 1.369 . . . . 0.0 111.194 174.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -63.31 -44.17 95.71 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.98 1.264 . . . . 0.0 112.603 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.24 -49.03 79.23 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 122.707 0.403 . . . . 0.0 111.151 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.4 pp -70.99 -31.98 46.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 118.289 -0.863 . . . . 0.0 112.497 174.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 79.3 t80 . . . . . 0 N--CA 1.471 0.614 0 CA-C-N 120.345 1.43 . . . . 0.0 111.904 178.154 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo . . . . . 0 CA--C 1.535 0.546 0 CA-C-O 121.143 0.393 . . . . 0.0 111.684 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -62.79 -22.5 66.66 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 176.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.9 m -62.61 -51.64 66.52 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.911 1.232 . . . . 0.0 112.256 174.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 9.4 p -73.6 -38.81 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 O-C-N 121.755 -0.591 . . . . 0.0 111.163 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 29.6 mmtt -58.31 -49.29 77.69 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.53 -0.731 . . . . 0.0 111.922 174.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -66.68 -43.56 84.14 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.445 1.02 . . . . 0.0 113.024 177.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -64.98 -36.74 85.39 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.368 -0.832 . . . . 0.0 112.429 179.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.67 -22.03 26.34 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.288 1.035 . . . . 0.0 113.128 179.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 . . . . . 0 N--CA 1.476 0.858 0 C-N-CA 125.703 1.601 . . . . 0.0 112.132 179.27 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 CA--C 1.547 1.125 0 CA-C-O 119.136 -0.443 . . . . 0.0 111.88 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -71.23 -23.58 24.22 Favored 'Trans proline' 0 CA--C 1.554 1.476 0 C-N-CA 122.32 2.013 . . . . 0.0 116.888 167.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -71.97 168.91 22.62 Favored 'Trans proline' 0 C--N 1.361 1.232 0 CA-C-N 124.26 2.557 . . . . 0.0 113.156 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -61.93 130.08 29.72 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.831 2.354 . . . . 0.0 110.988 173.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -55.04 -42.53 72.77 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.922 0.868 . . . . 0.0 111.632 174.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -78.73 17.02 0.75 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 127.991 2.516 . . . . 0.0 115.363 177.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -33.25 103.61 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 127.24 2.216 . . . . 0.0 115.325 -173.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.45 32.87 0.11 Allowed Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.095 1.331 . . . . 0.0 114.548 -172.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -125.23 157.79 66.12 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 125.621 1.568 . . . . 0.0 112.021 -175.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -74.44 169.08 23.32 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.065 2.51 . . . . 0.0 113.053 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -53.55 -37.29 62.74 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.65 1.18 . . . . 0.0 113.465 -177.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -57.27 -37.68 72.74 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.278 1.431 . . . . 0.0 112.671 176.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.0 t -82.65 -38.2 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.401 1.481 . . . . 0.0 112.194 174.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.1 t -57.56 -39.33 68.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.936 0.894 . . . . 0.0 110.742 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.5 tptm -61.13 -50.58 72.61 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.653 -1.28 . . . . 0.0 111.799 173.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -53.83 -47.27 71.09 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.237 0.615 . . . . 0.0 112.268 176.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -51.9 -52.97 46.11 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.388 1.075 . . . . 0.0 112.081 169.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -47.47 85.77 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.953 0.901 . . . . 0.0 113.331 -177.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.81 -38.89 92.79 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.422 0.689 . . . . 0.0 111.529 177.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 14.0 tp -63.71 -44.49 93.49 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 122.938 0.495 . . . . 0.0 111.969 172.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.58 -34.88 78.79 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.887 1.275 . . . . 0.0 113.871 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.9 mmtt -54.66 -32.95 59.97 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.844 1.202 . . . . 0.0 113.991 174.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.9 ttpp -69.1 -38.56 79.0 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.88 1.272 . . . . 0.0 112.715 172.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -104.17 14.35 30.6 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.709 1.604 . . . . 0.0 113.245 -172.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -22.3 41.58 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 120.33 -1.481 . . . . 0.0 114.694 -175.161 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.7 p -103.67 1.16 31.56 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 127.123 2.169 . . . . 0.0 114.847 179.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -76.81 170.65 16.08 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.39 1.476 . . . . 0.0 111.96 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.29 171.76 12.42 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.888 1.675 . . . . 0.0 111.915 175.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -50.97 -59.72 6.99 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 124.75 1.22 . . . . 0.0 112.218 174.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -67.03 -28.86 41.11 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.296 1.997 . . . . 0.0 113.479 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -67.53 -50.05 60.51 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.064 -1.648 . . . . 0.0 112.586 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.7 mt -62.97 -53.4 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 CA-C-N 118.662 0.665 . . . . 0.0 110.022 176.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -55.33 -42.33 73.65 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 117.866 -1.064 . . . . 0.0 111.244 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -57.56 -51.39 69.69 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-N 119.672 1.124 . . . . 0.0 112.066 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -40.74 96.63 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.433 HD11 ' HE1' ' A' ' 43' ' ' TRP . 3.2 mm? -61.13 -51.12 70.41 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.687 0.795 . . . . 0.0 111.789 172.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.85 -30.45 71.51 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.149 -0.97 . . . . 0.0 113.106 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.16 -49.05 78.8 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.129 -0.982 . . . . 0.0 112.346 178.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.433 ' HE1' HD11 ' A' ' 40' ' ' LEU . 10.8 p-90 -73.72 -35.52 65.11 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 173.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.65 -30.68 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 124.898 1.279 . . . . 0.0 112.401 176.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -57.27 -14.51 4.48 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.909 0.884 . . . . 0.0 112.912 174.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.79 -12.11 16.0 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.645 1.578 . . . . 0.0 113.833 176.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 17.5 mt . . . . . 0 N--CA 1.474 0.766 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 176.712 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -61.08 -53.5 56.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.829 1.252 . . . . 0.0 111.989 178.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.9 mtmt -60.14 -31.89 70.51 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 119.032 -0.509 . . . . 0.0 112.344 175.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.43 -51.47 23.74 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.837 0.744 . . . . 0.0 111.455 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -58.76 -49.29 78.19 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.744 0.817 . . . . 0.0 110.791 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -60.96 -52.27 65.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.773 1.229 . . . . 0.0 112.131 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.8 -44.7 96.35 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 119.797 1.18 . . . . 0.0 113.258 179.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -67.53 -45.08 76.77 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.456 0.703 . . . . 0.0 111.954 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.01 -51.23 70.1 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.119 0.967 . . . . 0.0 110.949 170.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.4 -42.93 99.52 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.057 -179.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -56.31 -50.76 70.53 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.558 1.072 . . . . 0.0 111.965 173.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.55 82.05 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -60.65 -49.44 77.51 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.049 0.94 . . . . 0.0 111.046 176.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.63 -42.64 83.79 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.086 1.354 . . . . 0.0 112.993 175.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -56.25 -52.59 63.91 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.324 1.05 . . . . 0.0 112.171 172.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.88 -31.52 72.17 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 177.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.1 t -73.06 -24.8 21.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 125.812 1.645 . . . . 0.0 113.086 176.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.65 -30.59 65.54 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 177.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.2 1.28 54.8 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.729 1.611 . . . . 0.0 114.406 172.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.3 ttm -103.53 -158.57 0.67 Allowed 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 126.429 1.891 . . . . 0.0 111.558 -172.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.76 156.11 36.65 Favored Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 125.179 1.391 . . . . 0.0 113.958 178.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.65 -43.86 1.21 Allowed 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 123.44 2.76 . . . . 0.0 113.084 -176.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -58.97 -34.3 71.65 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.329 1.052 . . . . 0.0 112.107 175.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.72 -43.59 88.61 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 122.998 0.519 . . . . 0.0 110.241 177.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -42.82 77.26 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.219 1.008 . . . . 0.0 112.056 173.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -59.83 -54.29 47.99 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.466 1.107 . . . . 0.0 111.563 175.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.43 -51.52 69.53 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.232 1.013 . . . . 0.0 113.085 178.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.6 -34.83 76.45 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 179.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.35 -51.67 68.95 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.46 1.027 . . . . 0.0 109.92 172.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -52.93 -51.96 59.5 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.808 0.843 . . . . 0.0 111.947 173.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.27 -37.86 84.65 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.7 t -72.98 -37.72 66.92 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.282 1.033 . . . . 0.0 112.541 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -38.86 56.73 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 121.706 -0.621 . . . . 0.0 111.694 177.35 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 12.0 tt -70.71 -31.62 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 119.148 0.886 . . . . 0.0 112.778 175.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.11 -33.38 67.28 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 . . . . . 0 CA--C 1.544 0.749 0 C-N-CA 124.147 0.979 . . . . 0.0 113.559 171.583 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -48.52 -38.93 21.58 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.411 1.085 . . . . 0.0 113.36 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -59.3 -59.35 5.6 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.845 0.858 . . . . 0.0 111.626 174.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.89 -33.38 75.69 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -177.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.59 -51.02 71.68 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.645 1.178 . . . . 0.0 110.53 171.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -52.75 -51.88 58.78 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 117.715 -1.136 . . . . 0.0 111.095 172.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 10.4 mm -53.68 -48.5 60.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.284 0.947 . . . . 0.0 111.582 177.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -65.08 -44.11 89.99 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.31 -0.869 . . . . 0.0 113.209 178.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.08 78.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.951 0.9 . . . . 0.0 112.126 177.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.49 -37.15 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 122.853 0.461 . . . . 0.0 111.891 175.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 70.1 t80 . . . . . 0 N--CA 1.47 0.574 0 CA-C-N 119.458 1.026 . . . . 0.0 112.194 176.689 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo . . . . . 0 CA--C 1.538 0.719 0 CA-C-O 121.802 0.667 . . . . 0.0 112.932 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -63.98 -24.89 67.89 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.547 -0.721 . . . . 0.0 112.865 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.9 t -61.22 -51.64 68.14 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.229 -0.919 . . . . 0.0 111.981 177.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.1 p -73.97 -38.12 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 121.737 -0.602 . . . . 0.0 112.051 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.47 -48.84 76.26 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.073 0.851 . . . . 0.0 111.706 171.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -67.93 -42.5 80.94 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.306 0.957 . . . . 0.0 112.96 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -65.99 -34.25 77.67 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.137 0.881 . . . . 0.0 112.592 177.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.08 -22.82 25.18 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 178.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 . . . . . 0 N--CA 1.477 0.882 0 C-N-CA 125.511 1.525 . . . . 0.0 113.011 179.882 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo . . . . . 0 CA--C 1.543 0.947 0 CA-C-O 119.413 -0.328 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -67.64 -24.77 41.14 Favored 'Trans proline' 0 CA--C 1.554 1.497 0 C-N-CA 122.669 2.246 . . . . 0.0 116.492 167.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.6 166.36 26.16 Favored 'Trans proline' 0 C--N 1.361 1.223 0 CA-C-N 124.093 2.497 . . . . 0.0 112.8 175.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.445 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 35.0 Cg_endo -59.15 131.3 40.54 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 123.099 2.533 . . . . 0.0 111.626 171.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -48.4 -47.22 37.87 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.415 0.686 . . . . 0.0 111.818 170.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -83.47 18.06 1.96 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 126.6 1.96 . . . . 0.0 115.219 -178.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -32.92 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 127.018 2.127 . . . . 0.0 115.611 -172.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.09 27.71 0.17 Allowed Glycine 0 CA--C 1.537 1.453 0 C-N-CA 124.814 1.197 . . . . 0.0 114.448 -172.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.79 157.45 59.84 Favored Pre-proline 0 CA--C 1.552 1.036 0 C-N-CA 125.722 1.609 . . . . 0.0 111.663 -175.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -73.36 168.37 24.94 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.114 2.543 . . . . 0.0 112.923 -178.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -54.76 -38.24 66.97 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.532 1.133 . . . . 0.0 113.464 -177.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.76 -40.9 66.61 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.517 1.527 . . . . 0.0 112.428 173.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.1 t -80.69 -39.52 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 124.812 1.245 . . . . 0.0 111.683 176.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 59.5 t -56.28 -40.91 68.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.077 0.951 . . . . 0.0 111.105 177.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.7 tptm -61.28 -50.69 72.01 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 121.132 -0.98 . . . . 0.0 111.968 173.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -53.36 -47.58 69.29 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.531 0.733 . . . . 0.0 112.042 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.445 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -52.06 -53.79 38.02 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.676 1.191 . . . . 0.0 112.156 169.742 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.33 -47.61 84.77 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.27 0.941 . . . . 0.0 113.533 -178.305 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -68.61 -28.76 67.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.477 0.711 . . . . 0.0 112.295 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.3 tp -68.75 -48.53 63.51 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 121.56 -0.713 . . . . 0.0 111.668 165.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.71 -34.65 73.18 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.652 1.581 . . . . 0.0 113.905 -178.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -30.72 47.42 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.924 1.238 . . . . 0.0 113.099 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.4 -34.33 70.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.882 1.673 . . . . 0.0 112.372 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -109.85 16.84 21.73 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.952 2.101 . . . . 0.0 113.15 -175.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -20.59 56.65 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 119.974 -1.704 . . . . 0.0 114.529 -174.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.1 m -102.24 0.77 34.95 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.849 2.06 . . . . 0.0 113.086 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -74.33 175.96 7.15 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.23 1.412 . . . . 0.0 111.875 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.65 174.7 6.86 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.4 1.88 . . . . 0.0 111.902 175.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.78 -60.69 3.84 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 126.539 1.935 . . . . 0.0 112.774 172.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.85 -33.77 25.88 Favored 'Trans proline' 0 C--N 1.357 1.014 0 C-N-CA 121.881 1.721 . . . . 0.0 113.284 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -65.06 -46.16 82.32 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.118 -0.989 . . . . 0.0 112.224 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 66.7 mt -67.73 -53.29 32.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 122.931 0.493 . . . . 0.0 110.371 175.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -56.38 -38.33 71.3 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 118.403 0.547 . . . . 0.0 111.835 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -58.19 -57.17 14.02 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 125.227 1.411 . . . . 0.0 113.016 173.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -65.8 -35.47 80.79 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.756 0.312 . . . . 0.0 111.672 -175.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -64.54 -49.46 71.16 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.977 1.311 . . . . 0.0 111.732 170.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.26 -41.0 71.61 Favored 'General case' 0 N--CA 1.465 0.319 0 O-C-N 121.177 -0.952 . . . . 0.0 113.303 174.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.64 -48.7 71.95 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -175.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 8.1 p-90 -72.92 -36.01 67.16 Favored 'General case' 0 CA--C 1.554 1.119 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 168.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -32.85 39.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 125.258 1.423 . . . . 0.0 112.364 175.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -60.1 -15.63 25.04 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.827 0.851 . . . . 0.0 112.762 177.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 21.5 m -100.88 -17.99 16.58 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.414 1.486 . . . . 0.0 112.614 176.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 17.8 mt . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 178.238 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -51.93 64.02 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 124.866 1.266 . . . . 0.0 112.502 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -55.68 -38.65 69.92 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.918 0.887 . . . . 0.0 111.038 172.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.64 -46.92 67.92 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 123.117 0.567 . . . . 0.0 111.884 -178.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -59.57 -53.26 60.16 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.249 1.02 . . . . 0.0 111.581 175.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.2 -38.27 89.94 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.71 -50.85 69.49 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.316 0.962 . . . . 0.0 112.409 175.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.98 -44.61 84.42 Favored 'General case' 0 C--O 1.245 0.816 0 C-N-CA 123.197 0.599 . . . . 0.0 112.037 -178.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 26.6 mt -59.13 -51.29 70.66 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 124.297 1.039 . . . . 0.0 111.788 173.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.13 -40.87 97.38 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.996 179.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.8 tttm -58.29 -51.11 71.17 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.098 1.317 . . . . 0.0 111.994 174.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.0 -48.77 78.83 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.27 0.628 . . . . 0.0 112.44 177.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -58.87 -50.04 75.51 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.306 1.042 . . . . 0.0 110.941 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.11 -41.72 84.19 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.332 1.453 . . . . 0.0 113.269 175.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -55.76 -52.58 63.45 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.55 1.14 . . . . 0.0 112.209 172.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.55 -31.84 72.19 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 54.1 t -73.26 -24.27 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 C-N-CA 125.512 1.525 . . . . 0.0 112.783 176.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.68 -34.62 65.2 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 176.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.9 pttt -84.4 0.18 50.43 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.297 1.439 . . . . 0.0 114.349 174.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.7 ttm -103.0 -159.64 0.74 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.947 2.099 . . . . 0.0 111.445 -173.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -58.72 154.78 34.19 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 125.339 1.456 . . . . 0.0 113.665 178.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -68.51 -45.73 2.34 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.573 2.849 . . . . 0.0 112.762 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -33.48 72.63 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.966 1.306 . . . . 0.0 112.893 176.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.97 -48.72 75.32 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 122.795 0.438 . . . . 0.0 110.218 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.2 -44.84 68.28 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.95 173.365 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -59.44 -55.44 34.58 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.522 1.055 . . . . 0.0 110.903 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.89 -51.49 69.38 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.242 0.617 . . . . 0.0 112.251 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.75 -39.25 93.83 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.5 -44.44 94.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.26 0.936 . . . . 0.0 111.104 174.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.55 -45.42 88.99 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.502 0.721 . . . . 0.0 112.782 172.07 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 7.8 mp -64.47 -34.77 78.97 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.888 0.767 . . . . 0.0 112.372 173.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 15.6 t -70.9 -45.12 64.88 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 120.686 -1.259 . . . . 0.0 112.903 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? -66.47 -49.24 67.28 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.225 0.61 . . . . 0.0 109.987 175.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.1 tt -65.32 -32.39 58.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 118.958 0.799 . . . . 0.0 112.509 -176.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.34 -19.4 63.31 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 N--CA 1.475 0.793 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 170.637 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -46.94 -32.49 3.88 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.217 1.407 . . . . 0.0 113.247 169.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -55.56 -60.09 3.91 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.119 0.967 . . . . 0.0 111.336 169.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.99 -34.05 77.22 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.212 -0.93 . . . . 0.0 112.332 -176.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.71 -54.58 42.56 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.866 0.866 . . . . 0.0 110.83 171.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -56.06 -52.49 64.08 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 118.375 -0.821 . . . . 0.0 112.062 174.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.9 mm -51.84 -49.19 37.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.208 1.403 . . . . 0.0 111.073 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -67.15 -43.77 81.48 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.683 1.129 . . . . 0.0 112.842 178.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.14 -49.19 78.82 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.83 0.852 . . . . 0.0 111.319 177.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.4 pp -68.76 -37.3 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 118.615 -0.707 . . . . 0.0 112.247 174.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.6 t80 . . . . . 0 N--CA 1.473 0.705 0 C-N-CA 124.744 1.218 . . . . 0.0 112.68 177.568 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo . . . . . 0 CA--C 1.535 0.554 0 CA-C-O 121.747 0.645 . . . . 0.0 112.548 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.06 -23.95 66.8 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.912 176.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 61.3 m -68.72 -39.22 80.51 Favored 'General case' 0 C--N 1.352 0.677 0 CA-C-O 117.346 -1.312 . . . . 0.0 114.217 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.3 p -79.6 -37.82 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-N 119.098 0.863 . . . . 0.0 110.189 175.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -57.55 -48.26 79.8 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.126 0.875 . . . . 0.0 111.669 173.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -68.34 -43.01 78.45 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.086 0.857 . . . . 0.0 112.541 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -64.95 -32.87 74.8 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.251 -0.905 . . . . 0.0 112.859 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.86 -19.94 22.83 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.355 1.062 . . . . 0.0 113.418 179.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.477 0.913 0 C-N-CA 125.084 1.354 . . . . 0.0 112.815 178.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 . . . . . 0 CA--C 1.551 1.01 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -112.19 93.01 4.24 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.153 1.381 . . . . 0.0 110.756 177.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.8 p -138.83 160.38 63.26 Favored Pre-proline 0 N--CA 1.469 0.515 0 C-N-CA 125.348 1.459 . . . . 0.0 111.976 -176.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -66.91 169.26 15.19 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 123.576 2.851 . . . . 0.0 112.914 175.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.8 116.56 4.03 Favored 'Trans proline' 0 CA--C 1.548 1.176 0 C-N-CA 123.091 2.527 . . . . 0.0 112.043 172.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -73.7 -19.08 21.65 Favored 'Trans proline' 0 CA--C 1.554 1.493 0 C-N-CA 122.438 2.092 . . . . 0.0 116.604 165.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.78 168.39 23.91 Favored 'Trans proline' 0 C--N 1.362 1.24 0 CA-C-N 124.462 2.629 . . . . 0.0 112.353 176.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -60.44 127.96 24.51 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.673 2.249 . . . . 0.0 111.181 170.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -51.88 -41.71 62.12 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.522 0.677 . . . . 0.0 111.747 168.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -95.86 41.87 1.1 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 128.62 2.768 . . . . 0.0 112.954 176.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.6 112.68 0.58 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.873 1.269 . . . . 0.0 113.039 174.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.15 -16.45 2.12 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 126.128 1.823 . . . . 0.0 114.236 -177.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.05 160.42 78.37 Favored Pre-proline 0 CA--C 1.558 1.274 0 C-N-CA 125.535 1.534 . . . . 0.0 113.866 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -75.71 171.34 18.38 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.899 3.066 . . . . 0.0 113.545 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -53.86 -36.62 62.82 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.463 1.105 . . . . 0.0 113.785 -176.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -53.4 -42.34 66.87 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.711 1.604 . . . . 0.0 112.551 173.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 77.8 t -77.47 -41.55 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 124.649 1.18 . . . . 0.0 111.673 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.3 t -55.24 -37.81 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 118.641 0.655 . . . . 0.0 111.583 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.0 tptm -62.48 -50.67 70.49 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.245 -0.909 . . . . 0.0 111.865 172.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.49 -46.51 80.43 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.003 0.82 . . . . 0.0 112.515 176.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -53.84 49.17 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.775 0.83 . . . . 0.0 111.527 172.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -64.03 -44.93 91.05 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.521 1.055 . . . . 0.0 113.209 -178.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.42 -37.97 82.57 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.248 1.019 . . . . 0.0 111.589 177.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.6 tp -66.7 -46.02 76.92 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 122.966 0.506 . . . . 0.0 111.259 169.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.63 -42.53 95.41 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -178.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.36 -29.34 61.29 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.993 1.27 . . . . 0.0 113.361 177.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.7 tttp -72.67 -33.95 66.89 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.686 1.195 . . . . 0.0 112.989 175.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . 0.285 15.9 p30 -109.78 22.1 16.09 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.983 1.313 . . . . 0.0 113.934 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -58.72 -24.54 61.66 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.05 -1.656 . . . . 0.0 113.178 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 31.9 p -96.87 -0.89 47.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 127.522 2.329 . . . . 0.0 114.388 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -77.87 179.72 6.54 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.876 1.671 . . . . 0.0 112.969 173.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.86 171.5 9.56 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.378 2.271 . . . . 0.0 112.503 173.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -59.13 8.76 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 125.413 1.485 . . . . 0.0 112.556 175.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -66.43 -28.41 46.27 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 122.254 1.97 . . . . 0.0 113.65 -178.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -72.71 -39.89 66.6 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.439 -0.788 . . . . 0.0 111.669 -176.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 52.7 mt -70.52 -53.04 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.669 1.188 . . . . 0.0 110.21 171.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -57.97 -36.83 73.14 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 118.39 -0.814 . . . . 0.0 112.051 -176.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -52.79 -57.28 10.7 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.078 1.351 . . . . 0.0 111.77 172.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.38 -41.37 96.99 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.5 0.72 . . . . 0.0 111.691 -177.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.45 -47.45 85.67 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.001 0.92 . . . . 0.0 111.384 174.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -62.46 -38.6 90.43 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.323 1.049 . . . . 0.0 113.105 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.33 -49.93 68.58 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.405 -0.809 . . . . 0.0 112.578 179.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 7.6 p-90 -73.73 -33.93 64.54 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 172.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.44 -30.39 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 125.074 1.35 . . . . 0.0 112.82 174.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.83 -16.66 18.23 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 118.836 0.743 . . . . 0.0 112.875 176.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.44 -16.21 21.32 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.189 1.396 . . . . 0.0 113.902 173.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 40.2 mt -66.88 -65.11 0.72 Allowed 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.024 0.829 . . . . 0.0 112.629 175.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 77.59 90.8 0.3 Allowed Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.133 0.873 . . . . 0.0 112.592 -177.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -169.48 -167.24 29.75 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.204 1.383 . . . . 0.0 112.399 -178.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -56.66 -19.5 16.68 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.254 1.421 . . . . 0.0 113.426 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -55.88 -21.02 17.92 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.768 2.027 . . . . 0.0 113.545 173.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -36.56 63.25 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.126 1.77 . . . . 0.0 113.539 171.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.66 -40.64 72.89 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.122 0.969 . . . . 0.0 111.32 177.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -59.45 -43.75 93.12 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 117.941 -1.028 . . . . 0.0 111.575 168.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -56.96 -52.69 64.21 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 120.635 1.562 . . . . 0.0 112.911 172.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -58.5 -42.72 88.29 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.706 0.685 . . . . 0.0 111.673 -177.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.09 -37.17 69.63 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 178.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -64.41 -50.55 67.17 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 125.185 1.394 . . . . 0.0 112.173 177.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -53.76 -45.37 70.58 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 122.801 0.44 . . . . 0.0 110.876 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 49.4 mttm -59.94 -54.06 50.54 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.322 1.049 . . . . 0.0 113.125 172.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -55.32 -47.93 74.91 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.708 1.14 . . . . 0.0 112.604 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -61.5 -53.32 57.92 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 124.375 1.07 . . . . 0.0 112.156 177.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt -56.08 -35.6 67.16 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.574 0.749 . . . . 0.0 111.661 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.72 -50.57 34.85 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.838 0.855 . . . . 0.0 111.48 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.8 tttt -58.83 -49.71 76.7 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.554 0.742 . . . . 0.0 110.688 176.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -62.31 -49.16 76.74 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.636 0.774 . . . . 0.0 111.954 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.01 -44.55 94.5 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.006 0.821 . . . . 0.0 111.9 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -66.72 -46.27 76.03 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.601 0.761 . . . . 0.0 112.224 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.8 tt -54.93 -51.13 67.06 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.804 0.842 . . . . 0.0 111.166 169.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.52 -40.09 96.13 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 118.553 -0.736 . . . . 0.0 112.176 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -57.77 -50.92 71.63 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.724 1.21 . . . . 0.0 111.929 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.15 -48.56 73.13 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.314 0.646 . . . . 0.0 112.156 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -59.33 -48.91 79.83 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.161 0.984 . . . . 0.0 110.708 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -55.65 -46.36 77.48 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.763 1.225 . . . . 0.0 113.039 173.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -51.69 65.69 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.174 0.897 . . . . 0.0 111.772 176.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.43 -32.93 74.81 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 175.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 48.8 t -72.69 -25.42 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 125.312 1.445 . . . . 0.0 113.139 178.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.85 -29.63 67.1 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.1 ptmt -89.24 -3.19 58.64 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.863 1.665 . . . . 0.0 114.16 172.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.7 tpp -94.74 -163.54 1.06 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.339 1.856 . . . . 0.0 112.018 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -52.64 152.18 7.02 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 126.94 2.096 . . . . 0.0 114.118 172.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -72.52 -39.11 2.89 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.697 2.932 . . . . 0.0 113.876 -174.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -62.86 -33.04 74.44 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.102 -0.999 . . . . 0.0 112.437 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.26 -44.06 92.93 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.902 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.04 -42.63 65.92 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.098 1.359 . . . . 0.0 112.634 173.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.3 mmtm -65.5 -52.62 51.42 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.279 1.432 . . . . 0.0 111.681 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.87 -53.16 60.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.501 0.72 . . . . 0.0 112.16 173.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.31 -36.0 82.69 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.11 -48.48 81.53 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.133 0.879 . . . . 0.0 111.216 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -56.64 -49.58 74.6 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 171.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.2 mt -60.7 -35.17 75.62 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.543 0.737 . . . . 0.0 112.296 178.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.4 t -73.05 -46.55 51.11 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.678 1.191 . . . . 0.0 113.043 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -65.97 -43.03 89.05 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.514 -0.741 . . . . 0.0 110.89 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.1 tt -68.95 -34.62 65.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.88 -18.06 63.81 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -99.74 -19.16 16.88 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.282 1.033 . . . . 0.0 113.732 169.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -147.44 80.99 1.52 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.61 1.564 . . . . 0.0 112.014 -175.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -65.51 -25.1 67.31 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 120.655 -1.278 . . . . 0.0 113.246 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.8 t -67.21 -20.16 65.65 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.975 1.31 . . . . 0.0 113.861 177.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 78.5 mt -81.19 84.13 6.64 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.574 1.15 . . . . 0.0 110.379 173.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 14.1 m-20 -89.42 176.71 6.81 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.4 1.48 . . . . 0.0 112.146 170.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 93.89 -26.17 18.0 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.832 1.682 . . . . 0.0 114.029 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.85 -23.18 32.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-N 118.374 1.087 . . . . 0.0 112.54 176.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -48.72 -38.06 20.49 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.218 -0.926 . . . . 0.0 112.554 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -58.93 -59.33 5.63 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.289 0.636 . . . . 0.0 111.225 173.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.64 -35.37 80.79 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.934 0.788 . . . . 0.0 112.623 -176.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 9.0 tm0? -59.09 -46.25 88.77 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.926 0.89 . . . . 0.0 111.554 171.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -50.35 74.03 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.396 -0.812 . . . . 0.0 111.494 173.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 31.0 mm -51.11 -50.84 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 124.793 1.237 . . . . 0.0 110.797 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -64.03 -45.99 86.45 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.604 0.638 . . . . 0.0 112.053 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.15 -44.78 83.75 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.501 0.72 . . . . 0.0 111.8 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 28.0 pt -71.54 -41.11 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-O 118.746 -0.645 . . . . 0.0 112.556 173.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -57.15 -39.79 75.92 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.362 1.437 . . . . 0.0 112.857 -178.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -66.59 -16.03 63.87 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.125 1.37 . . . . 0.0 113.038 176.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.0 t -122.31 21.09 10.43 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.701 2.0 . . . . 0.0 113.102 176.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 30.1 mt -109.36 75.89 0.78 Allowed Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 126.544 1.938 . . . . 0.0 110.531 170.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.14 168.65 18.57 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.934 2.423 . . . . 0.0 111.975 171.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -63.2 -23.39 67.41 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.317 -0.865 . . . . 0.0 112.791 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.3 m -62.44 -51.7 66.48 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.318 0.963 . . . . 0.0 112.118 176.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 10.8 p -72.23 -39.96 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 118.249 0.477 . . . . 0.0 111.414 178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.82 -46.42 84.73 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.779 173.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -69.18 -40.27 78.19 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.605 1.093 . . . . 0.0 113.438 177.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -68.65 -31.28 70.31 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 121.039 -1.038 . . . . 0.0 113.055 177.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -93.34 -16.95 24.11 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.447 1.099 . . . . 0.0 113.594 178.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -53.38 -38.52 63.44 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.939 1.296 . . . . 0.0 112.367 174.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.7 tttt -80.64 -31.06 36.58 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 173.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 168.98 -97.16 0.12 Allowed Glycine 0 CA--C 1.532 1.154 0 N-CA-C 114.925 0.73 . . . . 0.0 114.925 172.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.35 61.05 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 125.643 1.577 . . . . 0.0 111.185 -171.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 51.65 74.75 0.26 Allowed Glycine 0 CA--C 1.54 1.604 0 C-N-CA 126.058 1.789 . . . . 0.0 113.076 -174.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.87 108.42 2.1 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.932 3.088 . . . . 0.0 111.984 -174.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 48.3 63.98 1.85 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.779 2.032 . . . . 0.0 113.771 -176.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 42.3 t -116.98 133.09 23.14 Favored Pre-proline 0 N--CA 1.48 1.033 0 C-N-CA 125.939 1.696 . . . . 0.0 110.495 -176.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -70.47 177.06 6.46 Favored 'Trans proline' 0 CA--C 1.546 1.109 0 C-N-CA 123.872 3.048 . . . . 0.0 113.302 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.252 1.236 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 175.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 . . . . . 0 CA--C 1.545 0.77 0 CA-C-O 121.003 0.43 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -153.03 -65.69 0.16 Allowed 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.232 -0.918 . . . . 0.0 112.327 174.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.7 p -115.58 162.79 23.22 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 126.86 2.064 . . . . 0.0 112.482 -179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.63 167.71 22.0 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.089 2.526 . . . . 0.0 113.506 176.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -64.4 127.13 18.34 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.79 2.993 . . . . 0.0 111.648 175.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.81 -25.29 39.54 Favored 'Trans proline' 0 CA--C 1.551 1.368 0 C-N-CA 122.442 2.095 . . . . 0.0 116.367 167.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.4 163.87 34.85 Favored 'Trans proline' 0 C--N 1.362 1.254 0 CA-C-N 124.116 2.506 . . . . 0.0 112.754 176.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 36.8 Cg_endo -61.4 133.81 48.17 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.9 2.4 . . . . 0.0 111.34 171.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -49.9 -43.67 49.67 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.335 0.654 . . . . 0.0 111.669 169.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -83.06 18.91 1.53 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.216 1.807 . . . . 0.0 115.102 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.36 105.59 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.625 1.97 . . . . 0.0 115.24 -173.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.28 26.68 0.2 Allowed Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.757 1.17 . . . . 0.0 114.661 -172.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -120.97 156.85 56.33 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 126.198 1.799 . . . . 0.0 112.01 -174.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -73.45 166.39 29.98 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 123.394 2.73 . . . . 0.0 113.239 -178.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -52.46 -41.02 62.96 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.512 1.525 . . . . 0.0 113.133 -179.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -55.36 -39.54 70.18 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.883 1.673 . . . . 0.0 113.027 175.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 74.8 t -80.35 -40.33 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 124.881 1.273 . . . . 0.0 111.705 175.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.1 t -55.9 -39.81 58.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.876 0.87 . . . . 0.0 110.987 177.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -59.72 -50.66 72.96 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 121.002 -1.061 . . . . 0.0 112.178 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.57 -47.02 83.23 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.852 0.861 . . . . 0.0 111.818 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.429 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.9 OUTLIER -51.96 -50.09 61.93 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.498 1.119 . . . . 0.0 111.861 168.182 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -44.82 95.52 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.225 0.92 . . . . 0.0 113.038 -178.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -65.85 -34.86 79.13 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.546 -0.721 . . . . 0.0 111.789 176.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 tp -66.64 -41.05 88.87 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 171.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -72.23 -25.56 61.68 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.5 mmtt -53.62 -46.76 70.55 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.583 1.083 . . . . 0.0 113.051 175.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.0 ptmt -70.06 -24.77 63.3 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 173.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -104.21 17.56 23.88 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 126.761 2.025 . . . . 0.0 113.008 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.68 -19.07 65.52 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.185 -1.572 . . . . 0.0 113.175 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.2 p -98.6 3.41 47.96 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.871 2.469 . . . . 0.0 114.206 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -73.37 179.61 3.89 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.426 1.49 . . . . 0.0 112.802 173.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -117.65 172.49 7.32 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 127.513 2.325 . . . . 0.0 111.227 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.7 -57.62 6.53 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 126.544 1.938 . . . . 0.0 112.826 176.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -69.73 -37.33 9.38 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.349 2.033 . . . . 0.0 113.426 177.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -64.79 -41.57 95.72 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 120.788 -1.195 . . . . 0.0 112.269 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 56.8 mt -67.14 -53.29 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-O 118.431 -0.795 . . . . 0.0 109.428 174.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -57.39 -41.04 79.5 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.555 1.071 . . . . 0.0 112.187 -175.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.433 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 6.5 mmpt? -57.14 -60.79 3.08 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.3 1.44 . . . . 0.0 112.806 174.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.14 -33.96 77.27 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -174.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.93 -50.14 63.31 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 124.649 1.179 . . . . 0.0 111.235 173.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -55.28 -39.42 69.84 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.983 0.81 . . . . 0.0 112.912 175.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.36 -50.23 67.97 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 8.4 p-90 -73.8 -34.5 64.64 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 169.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -56.56 -32.19 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 125.194 1.397 . . . . 0.0 112.193 174.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.28 -19.27 44.74 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 118.935 0.789 . . . . 0.0 112.686 177.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 48.9 m -89.95 -24.49 21.28 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.983 1.313 . . . . 0.0 112.898 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 37.5 mt -64.12 -60.44 3.22 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 66.38 66.66 2.3 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.436 1.017 . . . . 0.0 114.044 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -147.71 53.04 0.54 Allowed Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.323 1.439 . . . . 0.0 113.758 -177.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.2 -3.12 2.15 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 128.705 2.802 . . . . 0.0 114.48 -176.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -62.32 -22.83 66.37 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.04 1.736 . . . . 0.0 114.252 -178.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.0 ptmt -53.58 -35.57 60.96 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.111 1.764 . . . . 0.0 113.427 172.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.78 -42.45 77.38 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.112 0.965 . . . . 0.0 112.147 176.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -56.85 -46.33 81.82 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.154 -0.966 . . . . 0.0 111.244 169.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -57.76 -46.12 84.97 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 174.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -58.31 -43.09 88.0 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.12 0.873 . . . . 0.0 110.975 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.99 -36.04 64.49 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -67.07 -52.64 39.63 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.077 -1.014 . . . . 0.0 112.604 174.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.2 ttpp -50.3 -52.33 37.49 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.733 0.813 . . . . 0.0 111.742 178.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 34.7 pttt -62.14 -42.06 98.88 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 118.185 -0.912 . . . . 0.0 113.418 175.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -57.38 -48.94 77.74 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.932 1.242 . . . . 0.0 111.73 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 13.3 mmt -64.27 -50.02 69.57 Favored 'General case' 0 N--CA 1.462 0.169 0 C-N-CA 123.032 0.533 . . . . 0.0 112.174 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -57.38 -35.02 69.46 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.292 0.637 . . . . 0.0 112.197 175.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.83 -51.5 22.14 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.236 1.014 . . . . 0.0 111.805 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -50.98 70.79 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.758 0.823 . . . . 0.0 110.599 174.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -60.88 -50.43 73.47 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.213 0.605 . . . . 0.0 111.99 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.13 92.95 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.803 0.728 . . . . 0.0 112.65 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -64.02 -50.33 68.9 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.772 0.829 . . . . 0.0 112.088 176.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 42.2 mt -55.66 -51.07 68.48 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.417 1.087 . . . . 0.0 110.724 175.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.37 -51.35 65.09 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.118 0.967 . . . . 0.0 113.108 172.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -53.16 -50.74 63.97 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 120.218 1.372 . . . . 0.0 112.268 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.29 -48.85 74.1 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.424 0.689 . . . . 0.0 112.35 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -55.57 -52.88 62.27 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 123.804 0.842 . . . . 0.0 110.88 174.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -52.08 -46.96 65.4 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.997 2.119 . . . . 0.0 112.295 177.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -48.55 78.1 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.848 0.859 . . . . 0.0 112.26 174.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.63 -33.88 76.63 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 173.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 92.6 t -69.98 -28.14 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 125.293 1.437 . . . . 0.0 111.925 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.04 -20.2 37.28 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 176.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.91 1.31 26.6 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 126.299 1.84 . . . . 0.0 114.173 173.28 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 tpp -98.64 -161.59 0.89 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.701 2.001 . . . . 0.0 112.025 -175.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.1 156.5 20.1 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 125.507 1.523 . . . . 0.0 113.942 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.56 -42.55 2.5 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.728 2.952 . . . . 0.0 113.345 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.64 -36.55 83.18 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.899 1.28 . . . . 0.0 112.571 177.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.62 -40.99 89.38 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.756 175.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -56.12 -45.72 79.42 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 117.852 -1.07 . . . . 0.0 112.368 176.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.31 -53.73 50.87 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.375 1.47 . . . . 0.0 111.369 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.63 -55.05 36.66 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.653 0.781 . . . . 0.0 111.885 176.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.25 -32.35 71.5 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -176.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.92 -46.38 89.61 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.023 -1.048 . . . . 0.0 111.856 170.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -58.53 -50.42 73.82 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.445 0.698 . . . . 0.0 111.977 171.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.2 mp -57.83 -34.58 69.83 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.646 0.657 . . . . 0.0 111.833 174.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.5 t -69.82 -50.83 39.01 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.012 -1.055 . . . . 0.0 112.657 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? -64.71 -40.2 94.94 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 118.677 -0.678 . . . . 0.0 110.898 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.5 tp -70.37 -37.15 69.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 119.224 0.92 . . . . 0.0 111.824 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.93 -21.0 65.13 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -176.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.91 -5.34 14.36 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.903 1.281 . . . . 0.0 113.634 174.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -156.63 78.4 0.93 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.33 1.452 . . . . 0.0 113.374 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -66.4 -12.84 59.2 Favored 'General case' 0 CA--C 1.55 0.953 0 O-C-N 120.19 -1.569 . . . . 0.0 113.504 177.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 t -74.93 -6.07 47.22 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.003 1.721 . . . . 0.0 114.502 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.7 mt -113.63 84.18 1.98 Allowed 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.354 1.462 . . . . 0.0 110.72 -177.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -94.23 153.22 18.17 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.682 0.793 . . . . 0.0 111.555 172.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 141.78 -69.33 0.44 Allowed Glycine 0 CA--C 1.529 0.965 0 C-N-CA 124.688 1.137 . . . . 0.0 112.805 -177.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -59.66 -27.88 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 CA-C-N 118.214 1.007 . . . . 0.0 112.591 -178.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -41.3 -46.43 3.23 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.906 1.682 . . . . 0.0 113.025 170.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -59.67 -59.13 5.92 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.615 0.766 . . . . 0.0 111.617 176.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.23 -35.62 80.9 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.671 0.789 . . . . 0.0 112.833 -175.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -53.86 -50.9 65.25 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 124.784 1.233 . . . . 0.0 110.779 167.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.4 tttt -57.29 -49.2 76.84 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.424 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 9.9 mm -54.74 -48.67 72.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.898 0.879 . . . . 0.0 111.758 176.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -64.5 -45.12 88.65 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.296 0.953 . . . . 0.0 112.844 177.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.51 -48.92 79.79 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.433 1.093 . . . . 0.0 111.822 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -68.88 -38.41 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.061 0.544 . . . . 0.0 112.142 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -62.56 -30.97 71.7 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.61 1.095 . . . . 0.0 113.016 177.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 10.2 mmtt -77.68 -11.1 59.84 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.111 1.364 . . . . 0.0 113.948 176.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.7 t -130.82 22.82 4.98 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.482 1.513 . . . . 0.0 112.763 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.02 142.87 7.07 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 126.121 1.769 . . . . 0.0 112.9 -177.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -70.85 110.74 2.85 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.27 1.98 . . . . 0.0 110.45 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -55.05 -30.46 59.63 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.596 -0.69 . . . . 0.0 111.818 176.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 46.7 p -56.69 -50.73 71.26 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.066 1.746 . . . . 0.0 113.202 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.94 -41.79 94.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 CA-C-N 119.619 1.099 . . . . 0.0 110.507 177.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -62.55 -46.27 89.15 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.356 177.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.52 -37.86 87.97 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.978 1.263 . . . . 0.0 113.244 176.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.74 -37.43 73.46 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.271 -0.893 . . . . 0.0 112.531 177.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -87.02 -19.11 29.14 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.445 1.098 . . . . 0.0 113.272 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.08 -37.44 61.67 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.789 1.636 . . . . 0.0 112.131 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -68.81 -43.88 74.66 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.186 1.394 . . . . 0.0 112.134 175.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 46.19 -136.03 8.98 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 125.243 1.401 . . . . 0.0 112.037 -175.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.1 pp -148.74 54.1 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 126.075 1.75 . . . . 0.0 111.542 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 49.84 75.1 0.22 Allowed Glycine 0 CA--C 1.54 1.606 0 C-N-CA 125.876 1.703 . . . . 0.0 113.115 -174.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -69.93 156.58 62.54 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.131 2.554 . . . . 0.0 111.993 -175.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 59.8 108.14 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 127.021 2.128 . . . . 0.0 113.13 -171.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 7.5 t -116.23 72.83 4.98 Favored Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 124.354 1.062 . . . . 0.0 110.366 177.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -74.23 -11.2 22.94 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.707 2.938 . . . . 0.0 114.144 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.18 0 C-N-CA 129.533 3.133 . . . . 0.0 114.49 -177.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.9 t70 . . . . . 0 N--CA 1.476 0.85 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.2 89.47 0.65 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.335 1.454 . . . . 0.0 111.984 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 p -96.47 160.48 29.48 Favored Pre-proline 0 C--O 1.238 0.465 0 C-N-CA 125.218 1.407 . . . . 0.0 112.458 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.71 162.84 37.64 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.779 2.986 . . . . 0.0 111.664 176.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -64.65 126.69 17.24 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.826 2.35 . . . . 0.0 110.772 175.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -68.19 -22.54 40.49 Favored 'Trans proline' 0 CA--C 1.552 1.383 0 C-N-CA 122.341 2.027 . . . . 0.0 116.281 167.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -69.89 167.95 23.13 Favored 'Trans proline' 0 C--N 1.362 1.274 0 CA-C-N 124.531 2.654 . . . . 0.0 113.828 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.425 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 36.7 Cg_endo -61.21 119.74 7.05 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 123.629 2.886 . . . . 0.0 111.772 173.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -54.0 -27.87 34.47 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 172.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -108.08 35.34 3.18 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 128.122 2.569 . . . . 0.0 112.693 178.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -41.93 112.46 0.33 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.475 1.51 . . . . 0.0 114.044 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 151.42 -17.66 0.89 Allowed Glycine 0 CA--C 1.539 1.553 0 C-N-CA 126.588 2.042 . . . . 0.0 113.929 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.14 159.25 65.65 Favored Pre-proline 0 CA--C 1.553 1.089 0 C-N-CA 125.598 1.559 . . . . 0.0 113.919 -175.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.66 172.19 16.71 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.643 2.895 . . . . 0.0 113.27 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -53.65 -34.07 57.37 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.549 1.139 . . . . 0.0 113.438 -179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.62 -36.08 71.31 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.503 1.521 . . . . 0.0 112.65 175.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 43.3 t -79.14 -43.02 24.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 125.113 1.365 . . . . 0.0 111.553 170.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 86.0 t -53.36 -37.9 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 119.035 0.834 . . . . 0.0 111.642 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tppt? -61.14 -51.1 70.49 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.001 -1.062 . . . . 0.0 112.402 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.12 -49.48 76.83 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.668 0.787 . . . . 0.0 111.283 176.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.425 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -51.06 -52.34 44.29 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.33 1.052 . . . . 0.0 111.827 171.655 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -61.41 -45.47 94.2 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.89 1.223 . . . . 0.0 113.226 -178.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -69.83 -26.42 64.22 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 122.949 0.5 . . . . 0.0 112.282 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -72.84 -54.15 9.56 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.005 0.922 . . . . 0.0 111.903 168.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.22 -43.12 82.54 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.704 1.602 . . . . 0.0 114.131 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.91 -27.11 64.94 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.508 1.049 . . . . 0.0 112.942 175.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -38.08 66.94 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.966 1.706 . . . . 0.0 112.501 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.98 19.47 19.53 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.08 2.152 . . . . 0.0 113.99 177.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -59.23 -23.54 62.4 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 119.595 -1.941 . . . . 0.0 113.418 -176.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.2 p -82.14 2.13 32.94 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 128.929 2.892 . . . . 0.0 115.072 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -93.08 -176.06 4.05 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 126.548 1.939 . . . . 0.0 112.417 173.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.45 167.15 11.17 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.31 2.244 . . . . 0.0 111.745 174.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -43.5 -59.8 3.06 Favored Pre-proline 0 N--CA 1.473 0.705 0 C-N-CA 125.704 1.602 . . . . 0.0 113.313 174.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -66.75 -35.82 26.54 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 121.827 1.684 . . . . 0.0 113.642 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.42 -50.77 71.48 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.686 1.194 . . . . 0.0 111.324 -177.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 10.4 mt -66.94 -48.43 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.3 1.04 . . . . 0.0 112.379 172.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -49.49 -46.07 47.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.643 0.777 . . . . 0.0 110.574 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -52.04 -47.78 64.88 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.508 1.049 . . . . 0.0 113.328 174.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -63.13 -49.16 75.47 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.286 1.034 . . . . 0.0 111.79 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.75 -48.93 79.52 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.975 0.91 . . . . 0.0 110.433 176.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -58.54 -35.29 72.09 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 125.008 1.323 . . . . 0.0 114.297 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.15 -53.49 57.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.553 0.615 . . . . 0.0 112.437 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -73.29 -29.75 62.93 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 113.18 0.808 . . . . 0.0 113.18 175.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 1.6 t -60.22 -33.51 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.301 1.84 . . . . 0.0 113.588 172.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -56.71 -15.24 4.19 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 119.115 0.87 . . . . 0.0 112.818 173.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.18 -6.7 16.28 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.587 1.555 . . . . 0.0 114.147 176.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.6 mt -63.29 -60.02 3.94 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.671 1.123 . . . . 0.0 113.415 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -167.1 -150.59 6.5 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 125.686 1.612 . . . . 0.0 110.589 -168.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -123.8 4.89 9.17 Favored Glycine 0 N--CA 1.47 0.961 0 N-CA-C 116.988 1.555 . . . . 0.0 116.988 -174.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -102.82 -37.5 7.83 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.808 1.643 . . . . 0.0 111.983 173.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -74.63 -24.26 58.82 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.045 0.938 . . . . 0.0 112.171 -177.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.97 -33.1 62.1 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.543 1.537 . . . . 0.0 113.732 170.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.19 -33.19 75.22 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.13 0.572 . . . . 0.0 111.336 176.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -63.61 -39.55 94.66 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.692 172.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -64.62 -54.15 36.41 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 119.657 1.117 . . . . 0.0 113.192 174.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.48 -40.73 87.91 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.933 -0.48 . . . . 0.0 111.809 -178.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.6 -38.25 67.86 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.99 0.916 . . . . 0.0 112.452 178.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -55.8 -50.65 69.9 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 124.412 1.085 . . . . 0.0 111.475 173.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 ttmm -50.22 -49.83 51.55 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.535 0.607 . . . . 0.0 111.107 -177.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -59.7 -54.35 47.4 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.479 1.512 . . . . 0.0 113.744 172.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -52.63 -47.31 67.12 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.08 0.952 . . . . 0.0 112.066 178.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -61.97 -52.8 62.55 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.878 1.271 . . . . 0.0 112.335 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -54.74 -34.65 62.78 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.819 -0.61 . . . . 0.0 112.505 174.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.71 -51.96 24.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.97 0.805 . . . . 0.0 111.933 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -58.84 -47.45 84.81 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.37 0.668 . . . . 0.0 111.482 177.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -60.73 -50.95 71.4 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.739 1.216 . . . . 0.0 112.08 176.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.79 -49.61 74.83 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.773 1.169 . . . . 0.0 112.915 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -62.37 -50.67 70.65 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.878 0.871 . . . . 0.0 112.201 178.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tp -56.04 -50.3 71.33 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.662 0.785 . . . . 0.0 111.156 175.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.88 -45.75 85.9 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.347 1.059 . . . . 0.0 111.915 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.5 tptt -57.48 -48.42 79.25 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.564 1.075 . . . . 0.0 112.425 176.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.84 78.44 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.455 0.702 . . . . 0.0 112.254 176.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.39 -50.0 75.25 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.737 1.215 . . . . 0.0 110.878 178.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -51.96 -49.47 63.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 126.382 1.873 . . . . 0.0 112.401 172.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -56.18 -49.08 75.02 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.687 0.795 . . . . 0.0 111.97 178.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.9 -33.41 75.53 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 174.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 56.0 t -69.51 -27.54 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.814 1.246 . . . . 0.0 112.679 178.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.16 -28.73 42.19 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 175.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -98.63 -1.76 40.07 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.973 1.709 . . . . 0.0 114.463 175.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -90.24 -84.68 0.23 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.421 1.088 . . . . 0.0 111.251 175.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -129.97 154.21 81.14 Favored Pre-proline 0 N--CA 1.479 1.02 0 C-N-CA 126.508 1.923 . . . . 0.0 112.991 -173.488 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -69.93 -48.31 0.71 Allowed 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 123.683 2.922 . . . . 0.0 112.611 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -72.66 -33.72 66.75 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.88 -41.55 82.77 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 119.024 -0.513 . . . . 0.0 110.323 174.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.66 -48.98 74.13 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 117.87 -1.062 . . . . 0.0 110.302 173.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -56.38 -54.03 50.36 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.22 0.918 . . . . 0.0 110.736 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.08 -50.82 72.62 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.364 -0.835 . . . . 0.0 113.247 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -67.46 -44.16 79.3 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.815 0.846 . . . . 0.0 112.589 -177.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.86 93.77 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.441 1.097 . . . . 0.0 111.912 173.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.99 -44.02 94.79 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.163 0.585 . . . . 0.0 111.73 174.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -63.47 -35.05 79.17 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 172.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.3 t -69.6 -47.24 64.17 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.43 1.092 . . . . 0.0 112.485 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? -67.95 -41.58 82.25 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.615 0.766 . . . . 0.0 111.157 177.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 7.2 tt -71.07 -32.91 49.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 118.986 0.812 . . . . 0.0 112.6 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.64 -30.36 68.67 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.08 -4.43 16.61 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.755 1.222 . . . . 0.0 113.69 177.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -157.83 79.88 0.86 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.297 1.439 . . . . 0.0 112.718 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -64.92 -12.48 49.77 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 120.236 -1.54 . . . . 0.0 114.12 176.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.8 t -82.14 -14.05 56.28 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.261 1.425 . . . . 0.0 113.833 176.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 77.4 mt -76.69 84.1 3.32 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.03 -1.044 . . . . 0.0 110.921 169.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -92.62 169.25 10.66 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.265 1.026 . . . . 0.0 111.854 168.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 120.94 -74.3 0.34 Allowed Glycine 0 N--CA 1.47 0.91 0 C-N-CA 126.046 1.784 . . . . 0.0 111.801 177.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.39 -27.72 37.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 123.717 0.807 . . . . 0.0 112.578 -177.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -31.5 4.42 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.344 1.458 . . . . 0.0 114.078 173.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -62.15 -59.81 4.52 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.115 171.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -62.33 -35.13 78.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.394 0.997 . . . . 0.0 112.269 -177.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -59.11 -49.45 77.84 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.616 0.766 . . . . 0.0 112.416 172.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.59 -51.84 67.12 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 117.786 -1.102 . . . . 0.0 110.993 172.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 31.3 mm -49.72 -49.91 19.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.619 1.168 . . . . 0.0 111.355 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -62.09 -52.18 64.93 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.693 0.679 . . . . 0.0 111.856 176.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.1 -33.77 71.23 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.9 pt -79.33 -39.76 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 118.161 -0.923 . . . . 0.0 112.069 169.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 93.7 t80 -54.85 -38.95 68.1 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 121.308 1.867 . . . . 0.0 113.837 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.23 -16.98 64.61 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 174.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.7 t -132.67 35.66 3.58 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.246 2.218 . . . . 0.0 112.56 -177.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 9.3 mt -109.15 72.31 0.5 Allowed Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 126.919 2.088 . . . . 0.0 110.109 174.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.23 170.95 11.05 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 123.256 2.637 . . . . 0.0 112.734 173.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -59.16 -26.87 65.13 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 173.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 23.5 p -65.59 -50.08 66.41 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 120.027 1.285 . . . . 0.0 112.833 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.4 p -69.06 -39.3 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.42 0.688 . . . . 0.0 111.551 175.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 10.0 mtpt -59.13 -47.05 86.69 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 118.254 -0.879 . . . . 0.0 112.372 171.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -65.98 -41.28 91.35 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 119.971 1.26 . . . . 0.0 112.786 177.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.08 -37.06 80.8 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.986 -1.072 . . . . 0.0 112.835 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.44 -19.13 31.77 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.474 1.109 . . . . 0.0 113.309 178.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -55.56 -21.9 19.35 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.492 1.917 . . . . 0.0 113.922 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -57.3 -29.15 63.67 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.621 1.568 . . . . 0.0 113.326 170.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 122.08 -175.69 16.36 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 126.192 1.853 . . . . 0.0 113.672 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -132.77 63.76 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 126.315 1.846 . . . . 0.0 111.274 -171.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 51.4 75.3 0.22 Allowed Glycine 0 CA--C 1.542 1.772 0 C-N-CA 125.784 1.659 . . . . 0.0 113.348 -175.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -70.31 172.15 13.71 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.733 2.956 . . . . 0.0 112.958 -176.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -134.79 93.59 3.05 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.176 1.391 . . . . 0.0 111.637 -177.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 14.9 p -83.0 133.68 47.87 Favored Pre-proline 0 N--CA 1.477 0.895 0 C-N-CA 124.733 1.213 . . . . 0.0 111.264 175.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -70.92 -178.39 2.76 Favored 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 123.741 2.961 . . . . 0.0 112.641 173.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.252 1.215 0 C-N-CA 125.374 1.47 . . . . 0.0 112.413 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 2.2 t70 . . . . . 0 CA--C 1.548 0.871 0 CA-C-O 120.952 0.406 . . . . 0.0 111.804 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.95 145.7 53.4 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 121.259 -0.901 . . . . 0.0 111.924 174.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -79.0 159.13 73.96 Favored Pre-proline 0 N--CA 1.474 0.747 0 C-N-CA 124.586 1.154 . . . . 0.0 113.343 177.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -69.94 167.53 24.41 Favored 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 123.77 2.98 . . . . 0.0 112.064 176.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.73 129.07 22.49 Favored 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 123.529 2.819 . . . . 0.0 111.578 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -67.21 -26.01 42.56 Favored 'Trans proline' 0 CA--C 1.55 1.321 0 C-N-CA 122.367 2.045 . . . . 0.0 115.928 167.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.66 162.9 39.13 Favored 'Trans proline' 0 C--N 1.362 1.245 0 CA-C-N 123.954 2.448 . . . . 0.0 112.834 177.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.43 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 34.6 Cg_endo -62.12 140.72 85.46 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.066 2.51 . . . . 0.0 111.827 171.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -52.32 -42.09 63.55 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.634 0.73 . . . . 0.0 112.221 171.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -84.76 19.22 2.11 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.604 1.962 . . . . 0.0 114.873 179.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -34.49 101.5 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.411 2.285 . . . . 0.0 115.548 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.64 29.1 0.14 Allowed Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.058 0.837 . . . . 0.0 114.498 -171.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.04 156.93 59.17 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 125.264 1.426 . . . . 0.0 111.692 -176.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -73.01 169.5 22.05 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.3 2.666 . . . . 0.0 112.777 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -54.12 -38.89 65.92 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.455 1.102 . . . . 0.0 113.423 -177.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.88 -39.24 68.5 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.523 1.529 . . . . 0.0 112.65 174.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.4 t -81.49 -39.63 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 124.899 1.28 . . . . 0.0 111.662 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 49.1 t -55.22 -40.95 58.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.881 0.872 . . . . 0.0 110.847 176.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -60.45 -50.66 72.68 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.929 -1.107 . . . . 0.0 112.378 175.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.24 -48.0 77.36 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.822 0.849 . . . . 0.0 111.855 177.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.43 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.6 OUTLIER -51.54 -50.73 59.46 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.094 0.958 . . . . 0.0 112.025 169.609 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.51 -47.38 86.4 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.968 0.804 . . . . 0.0 112.362 -177.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -66.48 -32.37 73.69 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.321 0.648 . . . . 0.0 112.096 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.6 tp -66.53 -49.08 67.67 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.563 0.745 . . . . 0.0 112.109 169.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.25 -25.13 68.18 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.526 1.53 . . . . 0.0 114.496 177.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -53.17 -33.11 51.16 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 119.888 1.222 . . . . 0.0 113.734 173.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.47 -38.81 65.31 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.296 1.038 . . . . 0.0 112.955 169.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -97.49 19.44 13.36 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.02 1.328 . . . . 0.0 113.096 -175.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.06 -19.83 63.33 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.323 -1.486 . . . . 0.0 114.395 -176.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.28 8.02 21.3 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 126.322 1.849 . . . . 0.0 113.002 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.5 mptt -75.8 178.97 5.76 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 120.638 -1.289 . . . . 0.0 111.658 176.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.09 171.27 7.47 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.441 1.897 . . . . 0.0 111.011 176.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -45.97 -59.08 5.19 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.825 1.65 . . . . 0.0 112.785 174.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.42 -38.57 19.46 Favored 'Trans proline' 0 C--N 1.357 1.016 0 C-N-CA 122.312 2.008 . . . . 0.0 112.613 178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.26 -41.87 97.66 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.121 -0.987 . . . . 0.0 112.117 -177.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 12.1 mt -69.43 -51.45 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.103 0.961 . . . . 0.0 110.213 171.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -51.0 -38.08 49.03 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.05 0.841 . . . . 0.0 112.502 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.01 -60.3 3.64 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.383 1.473 . . . . 0.0 111.643 -179.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -64.08 -37.4 87.3 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.216 0.606 . . . . 0.0 112.19 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -64.68 -50.61 66.36 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.641 0.776 . . . . 0.0 110.93 174.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -56.85 -37.97 72.04 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 118.949 0.795 . . . . 0.0 113.014 176.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.07 -50.8 65.95 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -178.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 9.4 p-90 -73.53 -36.38 65.69 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 170.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -56.89 -32.88 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.086 1.354 . . . . 0.0 112.118 175.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -59.73 -16.39 26.99 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.663 0.785 . . . . 0.0 112.538 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.8 m -102.01 -15.9 16.64 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.172 1.389 . . . . 0.0 112.607 177.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 15.2 mt -60.59 -56.22 23.92 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 177.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -179.11 -159.07 22.66 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 123.715 0.674 . . . . 0.0 112.572 -168.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -123.9 20.9 7.13 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 126.041 1.782 . . . . 0.0 114.383 -175.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -106.92 -38.16 6.13 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.938 1.695 . . . . 0.0 111.484 171.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.7 m-85 -71.88 -25.33 61.89 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.563 0.745 . . . . 0.0 112.389 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -54.1 -34.51 60.4 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 172.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.42 -45.61 72.12 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.698 0.799 . . . . 0.0 111.883 177.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -54.72 -46.32 74.19 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 118.544 -0.741 . . . . 0.0 110.632 169.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -57.79 -46.11 85.08 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 119.433 1.015 . . . . 0.0 113.716 175.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -58.27 -42.08 85.69 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.264 0.938 . . . . 0.0 111.225 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.39 -35.47 58.6 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -178.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -64.56 -52.01 59.84 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 125.036 1.334 . . . . 0.0 111.532 174.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.6 ttpp -50.18 -53.12 30.04 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.97 0.908 . . . . 0.0 112.069 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 27.1 pttt -60.92 -46.56 90.17 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 174.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -56.61 -49.37 75.14 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.221 1.008 . . . . 0.0 112.445 177.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.4 -52.36 58.6 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.572 1.549 . . . . 0.0 113.141 176.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -55.07 -34.83 63.94 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 118.585 -0.722 . . . . 0.0 112.143 173.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.27 -51.61 29.2 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.067 0.849 . . . . 0.0 111.778 178.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -58.62 -49.32 77.91 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.899 0.879 . . . . 0.0 111.469 176.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -64.3 -50.03 69.45 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.609 1.163 . . . . 0.0 112.2 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.03 -44.48 91.75 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.177 0.898 . . . . 0.0 111.87 176.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -65.07 -50.42 66.23 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.465 0.706 . . . . 0.0 111.882 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -53.72 -51.2 64.06 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.438 1.095 . . . . 0.0 110.557 172.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.05 -41.04 95.84 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.802 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.86 -50.65 72.96 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.338 1.055 . . . . 0.0 111.999 176.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.42 -47.76 84.28 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.754 0.822 . . . . 0.0 112.635 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -59.68 -51.14 71.06 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.944 0.897 . . . . 0.0 110.687 177.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -46.71 68.14 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.401 1.88 . . . . 0.0 112.968 174.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -54.79 -52.57 62.21 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.187 0.995 . . . . 0.0 112.388 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.99 -30.45 69.71 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 177.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 73.8 t -72.97 -22.57 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.808 1.643 . . . . 0.0 113.153 176.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.65 -30.53 63.44 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 176.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -87.53 0.17 55.96 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.295 1.438 . . . . 0.0 114.554 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.9 tpp -97.09 -162.12 0.93 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.193 1.797 . . . . 0.0 111.844 -177.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -53.41 154.85 5.7 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 126.768 2.027 . . . . 0.0 113.546 171.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -70.13 -43.99 2.06 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.389 2.726 . . . . 0.0 112.41 -177.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -62.45 -28.09 69.57 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.018 0.927 . . . . 0.0 113.26 176.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.33 -48.61 79.05 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.877 -0.514 . . . . 0.0 110.981 177.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.34 -41.26 60.45 Favored 'General case' 0 N--CA 1.482 1.158 0 O-C-N 121.492 -0.755 . . . . 0.0 111.678 173.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -61.75 -50.32 72.87 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.484 1.514 . . . . 0.0 111.433 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.93 -46.09 89.43 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-O 121.938 0.875 . . . . 0.0 113.079 177.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -65.75 -41.12 92.5 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 120.729 -1.232 . . . . 0.0 112.369 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.62 -38.89 89.28 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 117.826 -1.083 . . . . 0.0 112.277 171.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -55.24 -53.36 56.99 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.355 1.434 . . . . 0.0 111.593 170.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.14 -36.2 83.26 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-O 121.159 0.504 . . . . 0.0 112.061 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.5 t -73.49 -40.64 63.94 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.188 -0.945 . . . . 0.0 112.403 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.68 -49.48 58.65 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 117.901 -1.047 . . . . 0.0 109.433 174.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.1 tp -66.48 -29.66 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 119.873 1.215 . . . . 0.0 113.241 -175.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.15 -17.11 62.56 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 173.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -109.82 -28.26 8.87 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.852 1.661 . . . . 0.0 113.146 -178.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.53 147.02 24.0 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 127.363 2.265 . . . . 0.0 111.767 178.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -102.92 -44.96 5.1 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.924 1.29 . . . . 0.0 112.953 170.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t -124.05 -5.07 7.93 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.05 84.27 5.81 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.726 1.61 . . . . 0.0 110.914 -176.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 14.1 p30 -65.12 169.42 5.5 Favored 'General case' 0 CA--C 1.55 0.944 0 O-C-N 121.048 -1.032 . . . . 0.0 112.156 175.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 158.95 -12.41 0.2 Allowed Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.093 0.854 . . . . 0.0 114.411 -178.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 1.8 tp -54.54 -48.17 70.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-N 118.691 1.246 . . . . 0.0 112.184 168.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -43.48 -45.9 6.63 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -55.96 -59.4 4.96 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.876 1.27 . . . . 0.0 111.237 171.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.09 -38.28 73.11 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.177 0.991 . . . . 0.0 113.411 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.33 -49.16 78.71 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 126.327 1.851 . . . . 0.0 111.031 174.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.5 mttm -54.69 -48.2 72.72 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.046 -0.978 . . . . 0.0 111.6 173.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.6 mm -56.67 -48.66 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 CA-C-N 119.026 0.83 . . . . 0.0 111.462 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -58.73 -47.52 84.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.188 0.449 . . . . 0.0 111.579 177.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.81 -49.03 79.11 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.153 1.381 . . . . 0.0 112.075 -176.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.8 pt -68.81 -29.56 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 121.385 -0.822 . . . . 0.0 111.909 173.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -71.67 -30.92 66.25 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.529 1.059 . . . . 0.0 113.495 176.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.2 ptmt -83.97 -16.95 42.2 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 119.278 0.944 . . . . 0.0 113.305 172.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 71.1 p -121.48 20.69 11.14 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.873 1.669 . . . . 0.0 113.869 -177.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.75 151.16 0.63 Allowed Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 126.934 2.093 . . . . 0.0 114.051 176.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -66.84 157.09 63.04 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 121.81 1.673 . . . . 0.0 111.737 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 29.2 tp60 -63.58 -23.7 67.5 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.367 -0.833 . . . . 0.0 112.219 177.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.1 t -61.86 -51.52 67.88 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.2 1.4 . . . . 0.0 112.184 178.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.9 p -69.06 -37.02 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 O-C-N 121.72 -0.612 . . . . 0.0 111.561 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -60.22 -47.89 84.07 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.917 173.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -68.3 -39.66 81.98 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.458 1.027 . . . . 0.0 112.928 177.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.61 -37.09 82.03 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.097 -1.002 . . . . 0.0 112.246 177.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.89 -20.13 29.51 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.309 1.044 . . . . 0.0 113.571 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.95 -33.8 57.87 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.001 1.72 . . . . 0.0 112.574 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.53 -36.89 68.42 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.626 1.171 . . . . 0.0 112.365 173.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -75.42 -163.06 11.76 Favored Glycine 0 CA--C 1.538 1.517 0 C-N-CA 126.633 2.063 . . . . 0.0 113.427 172.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -136.25 64.64 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 125.426 1.491 . . . . 0.0 111.946 -167.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 49.67 74.82 0.24 Allowed Glycine 0 CA--C 1.54 1.63 0 C-N-CA 125.646 1.593 . . . . 0.0 113.413 -176.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -69.84 164.93 32.77 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.469 2.779 . . . . 0.0 112.548 -176.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -149.74 108.19 3.8 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.073 1.349 . . . . 0.0 110.736 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 7.0 t -126.31 75.71 73.14 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.878 1.271 . . . . 0.0 109.805 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -71.18 176.19 8.19 Favored 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.509 2.806 . . . . 0.0 112.124 174.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 . . . . . 0 C--O 1.253 1.272 0 C-N-CA 124.417 1.087 . . . . 0.0 112.798 173.423 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 123.026 1.393 . . . . 0.0 114.333 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -148.61 130.61 15.31 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.266 1.826 . . . . 0.0 110.908 178.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -63.46 158.83 55.57 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 124.196 0.998 . . . . 0.0 112.082 171.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -66.89 164.95 27.69 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.856 2.371 . . . . 0.0 111.579 178.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -64.41 115.65 3.31 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 122.99 2.46 . . . . 0.0 111.419 175.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -71.95 -20.47 25.6 Favored 'Trans proline' 0 CA--C 1.55 1.28 0 CA-C-O 115.652 -1.895 . . . . 0.0 116.121 167.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.36 166.5 29.1 Favored 'Trans proline' 0 C--N 1.363 1.303 0 CA-C-N 124.427 2.617 . . . . 0.0 112.219 176.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -59.16 132.37 46.58 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.859 2.372 . . . . 0.0 111.361 169.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -49.82 -46.47 51.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.273 0.629 . . . . 0.0 110.848 169.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.4 35.44 1.1 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.93 2.492 . . . . 0.0 113.785 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.12 110.75 0.19 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.497 1.519 . . . . 0.0 113.864 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.46 18.08 0.28 Allowed Glycine 0 CA--C 1.539 1.588 0 C-N-CA 125.453 1.501 . . . . 0.0 115.717 -174.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.4 160.84 38.09 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 125.857 1.663 . . . . 0.0 112.667 -170.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.09 170.35 20.58 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.504 2.803 . . . . 0.0 113.298 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -53.75 -35.24 61.02 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.49 -40.53 65.44 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.325 1.45 . . . . 0.0 112.692 173.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.5 t -81.45 -45.27 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 C-N-CA 125.398 1.479 . . . . 0.0 112.203 174.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 92.8 t -54.64 -38.6 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 123.573 0.749 . . . . 0.0 111.07 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -63.35 -50.6 69.35 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.202 -0.936 . . . . 0.0 112.084 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.41 -48.65 71.37 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.018 0.827 . . . . 0.0 112.356 176.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.11 -53.69 39.47 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.719 1.208 . . . . 0.0 111.597 171.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -62.96 -47.52 82.82 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -59.33 -41.36 88.96 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.583 1.153 . . . . 0.0 110.888 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 tp -60.91 -52.01 66.84 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 122.575 0.35 . . . . 0.0 111.306 169.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.45 -33.78 68.3 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 178.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -55.14 -35.16 64.43 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 120.449 1.477 . . . . 0.0 113.319 177.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -72.81 -25.26 61.08 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.993 1.317 . . . . 0.0 113.277 172.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -109.83 14.11 23.31 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 126.216 1.806 . . . . 0.0 113.488 -174.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -21.05 60.18 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.289 -1.507 . . . . 0.0 113.814 -171.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.6 p -109.22 2.47 20.95 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.474 2.31 . . . . 0.0 114.316 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -76.56 170.81 15.72 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.064 1.745 . . . . 0.0 111.906 176.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.51 172.02 12.02 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.768 1.227 . . . . 0.0 112.307 173.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -49.45 -63.5 1.66 Allowed Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 127.294 2.238 . . . . 0.0 112.302 173.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -62.21 -32.47 82.57 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 122.755 2.303 . . . . 0.0 113.328 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -64.65 -51.16 64.04 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.679 0.792 . . . . 0.0 111.885 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 50.8 mt -64.74 -52.52 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 124.291 1.036 . . . . 0.0 110.028 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -47.7 -52.05 19.69 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.25 1.82 . . . . 0.0 112.706 178.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -57.71 -44.29 85.8 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.306 0.957 . . . . 0.0 112.702 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.67 -43.29 97.13 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.191 0.997 . . . . 0.0 112.67 174.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.72 -48.98 79.28 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.19 1.396 . . . . 0.0 111.75 173.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -62.95 -37.66 87.96 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 177.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.3 -48.87 73.47 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 7.2 p-90 -73.88 -34.0 64.26 Favored 'General case' 0 CA--C 1.553 1.078 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 173.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -57.82 -32.46 43.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 124.724 1.21 . . . . 0.0 112.485 173.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.39 -15.78 29.4 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 118.677 0.671 . . . . 0.0 112.733 177.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 42.2 m -94.57 -21.44 18.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.947 1.299 . . . . 0.0 113.057 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 24.9 mt -59.4 -63.33 1.34 Allowed 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.23 93.31 0.41 Allowed Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.031 0.824 . . . . 0.0 112.485 -178.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 178.61 -163.5 31.39 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 124.962 1.268 . . . . 0.0 112.22 -177.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -57.37 -16.82 10.01 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.612 1.165 . . . . 0.0 113.911 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -54.18 -21.3 8.52 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.942 2.097 . . . . 0.0 113.887 172.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -36.03 66.78 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.837 1.655 . . . . 0.0 113.904 170.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.78 -39.87 84.03 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.933 0.873 . . . . 0.0 110.803 175.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.24 -39.66 87.49 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 117.513 -1.232 . . . . 0.0 112.31 169.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -60.23 -54.08 50.02 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 121.069 1.759 . . . . 0.0 113.09 171.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -58.59 -40.34 82.93 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.57 -0.706 . . . . 0.0 111.561 -177.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.07 -31.72 58.92 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 177.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -51.87 64.43 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.392 1.477 . . . . 0.0 111.132 171.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.9 ttmm -53.91 -50.03 67.3 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.267 0.354 . . . . 0.0 110.427 -175.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.3 mttt -62.04 -49.46 75.92 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.552 1.141 . . . . 0.0 113.746 172.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -52.18 -50.92 60.91 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.491 1.496 . . . . 0.0 112.114 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 13.2 mmt -73.84 -45.14 52.98 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.97 -35.24 70.91 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.373 0.533 . . . . 0.0 112.011 173.303 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.65 -50.59 35.12 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.754 1.222 . . . . 0.0 111.263 176.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.8 tptt -55.74 -53.26 58.8 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.783 0.719 . . . . 0.0 110.351 177.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -60.04 -51.73 68.41 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.923 1.289 . . . . 0.0 111.991 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.16 -45.8 93.15 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.599 1.09 . . . . 0.0 113.081 177.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -65.64 -46.65 78.42 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.731 0.813 . . . . 0.0 111.721 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 48.7 mt -57.69 -51.13 70.8 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.365 1.066 . . . . 0.0 111.014 172.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.52 88.62 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.705 0.802 . . . . 0.0 112.142 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -59.43 -50.92 72.08 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.329 1.052 . . . . 0.0 112.277 176.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.91 -47.88 84.37 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.835 0.854 . . . . 0.0 112.775 176.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -55.98 -54.21 47.61 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.844 0.858 . . . . 0.0 111.367 173.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.35 -42.27 77.49 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 119.75 1.159 . . . . 0.0 112.781 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -52.49 64.23 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.416 1.086 . . . . 0.0 112.559 171.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.91 -30.72 70.95 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 176.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 52.9 t -73.09 -25.06 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 126.407 1.883 . . . . 0.0 113.003 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.91 -30.86 66.24 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 177.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.7 pttt -86.68 0.2 55.04 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.168 1.387 . . . . 0.0 114.277 173.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.7 ttm -102.3 -160.3 0.78 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.67 1.988 . . . . 0.0 111.822 -173.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.18 156.12 22.47 Favored Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 125.391 1.476 . . . . 0.0 113.757 177.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.06 -46.19 1.62 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.415 2.743 . . . . 0.0 112.858 -176.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.71 -32.22 70.32 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.153 0.981 . . . . 0.0 112.463 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.72 -49.0 72.56 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.231 0.613 . . . . 0.0 109.96 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -54.33 -43.47 71.25 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 118.564 -0.731 . . . . 0.0 111.464 173.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -59.25 -54.71 43.76 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.255 0.934 . . . . 0.0 110.871 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.77 -49.01 79.24 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 177.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -70.37 -35.79 73.74 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.93 -44.71 88.6 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.906 1.23 . . . . 0.0 111.24 172.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -44.66 82.55 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.824 0.85 . . . . 0.0 111.883 172.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.73 -36.49 83.75 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 121.504 -0.748 . . . . 0.0 112.721 173.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.1 t -72.22 -37.63 69.16 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.786 -1.196 . . . . 0.0 112.644 -177.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -71.08 -51.4 25.4 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 118.911 -0.566 . . . . 0.0 110.032 173.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.5 tt -63.41 -29.77 48.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-N 119.111 0.869 . . . . 0.0 112.881 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.43 -24.2 63.3 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 177.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -110.68 -26.19 9.55 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.473 1.109 . . . . 0.0 113.758 170.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -111.3 81.04 1.38 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.665 1.586 . . . . 0.0 112.078 -174.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -13.11 48.85 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.933 1.293 . . . . 0.0 114.48 176.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 62.2 m -70.64 -18.28 62.86 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 176.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 22.4 mt -85.76 84.21 7.63 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.569 1.148 . . . . 0.0 109.874 176.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 51.6 m-20 -88.6 155.7 19.47 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.874 0.87 . . . . 0.0 111.459 172.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 74.96 12.83 83.07 Favored Glycine 0 CA--C 1.534 1.239 0 CA-C-O 118.964 -0.909 . . . . 0.0 115.223 -178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.42 -24.23 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 CA-C-N 119.312 1.556 . . . . 0.0 113.361 -174.085 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -47.49 -36.7 10.58 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.56 1.144 . . . . 0.0 113.283 171.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.9 mttt -60.47 -59.42 5.43 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.028 0.831 . . . . 0.0 111.238 173.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.55 -37.44 87.55 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.036 0.835 . . . . 0.0 111.942 -175.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.6 tm0? -53.27 -51.66 61.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.2 1.0 . . . . 0.0 110.892 171.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -59.51 -49.22 78.62 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 118.05 -0.976 . . . . 0.0 112.57 176.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 33.9 mm -50.74 -48.57 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.64 1.176 . . . . 0.0 110.947 174.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -66.8 -43.26 84.32 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 121.286 -0.884 . . . . 0.0 112.194 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.51 -42.52 92.43 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.524 1.129 . . . . 0.0 112.636 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.7 pp -74.86 -40.12 45.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 121.685 -0.634 . . . . 0.0 111.861 172.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -59.41 -29.87 68.06 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.731 1.213 . . . . 0.0 113.427 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.3 -17.94 14.39 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 175.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.9 t -59.46 -21.81 60.61 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.999 1.32 . . . . 0.0 113.55 177.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 40.6 mt -54.92 152.09 14.37 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.081 1.353 . . . . 0.0 112.736 174.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.04 156.18 66.8 Favored 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 122.528 2.152 . . . . 0.0 112.584 -176.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -59.22 -22.09 60.52 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 11.2 t -64.17 -51.7 62.56 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.538 1.063 . . . . 0.0 111.793 174.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.9 p -73.88 -38.01 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 O-C-N 121.7 -0.625 . . . . 0.0 111.502 178.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 mmmt -58.11 -49.5 76.73 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 118.521 -0.752 . . . . 0.0 111.896 172.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -68.2 -39.3 82.48 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.701 1.137 . . . . 0.0 113.388 178.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -67.23 -34.72 78.06 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.474 1.034 . . . . 0.0 112.641 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.51 -21.4 26.98 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.095 0.958 . . . . 0.0 113.148 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.11 -14.97 4.45 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.392 1.477 . . . . 0.0 113.909 177.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.429 ' HA ' ' HE2' ' A' ' 126' ' ' LYS . 2.3 mmpt? -62.79 -17.86 61.81 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 167.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -110.27 93.2 0.73 Allowed Glycine 0 CA--C 1.534 1.242 0 C-N-CA 126.005 1.764 . . . . 0.0 112.847 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -130.59 60.26 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.695 1.598 . . . . 0.0 112.623 -174.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 54.01 74.96 0.26 Allowed Glycine 0 CA--C 1.541 1.661 0 C-N-CA 125.469 1.509 . . . . 0.0 113.283 -177.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -70.9 92.45 0.62 Allowed 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 124.35 3.367 . . . . 0.0 113.216 -171.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -163.56 121.87 1.94 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 127.481 2.312 . . . . 0.0 109.962 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 42.8 t -116.47 130.16 24.71 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 125.786 1.634 . . . . 0.0 110.028 176.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -70.94 170.3 18.33 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.442 2.761 . . . . 0.0 112.914 178.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 . . . . . 0 C--O 1.254 1.304 0 C-N-CA 124.6 1.16 . . . . 0.0 112.819 179.205 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 . . . . . 0 CA--C 1.545 0.758 0 CA-C-O 121.312 0.577 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -152.12 117.5 5.3 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 125.011 1.324 . . . . 0.0 109.717 176.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -61.28 155.85 54.47 Favored Pre-proline 0 N--CA 1.472 0.638 0 C-N-CA 123.39 0.676 . . . . 0.0 111.955 171.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -68.77 170.4 15.43 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 123.052 2.501 . . . . 0.0 112.379 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -64.84 116.19 3.68 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.03 2.487 . . . . 0.0 111.491 176.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -70.32 -22.53 29.39 Favored 'Trans proline' 0 CA--C 1.552 1.402 0 CA-C-O 115.727 -1.864 . . . . 0.0 115.817 163.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.93 169.32 19.4 Favored 'Trans proline' 0 C--N 1.363 1.309 0 CA-C-N 124.222 2.544 . . . . 0.0 112.484 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -59.86 129.3 29.95 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.398 2.065 . . . . 0.0 110.357 171.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -47.67 -47.86 29.29 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.141 0.576 . . . . 0.0 110.964 170.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -91.56 38.77 0.99 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 128.997 2.919 . . . . 0.0 114.242 177.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.5 112.69 0.41 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.511 1.125 . . . . 0.0 113.609 174.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 143.65 -12.86 2.21 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.958 1.742 . . . . 0.0 114.616 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.31 161.29 75.45 Favored Pre-proline 0 CA--C 1.558 1.281 0 C-N-CA 125.342 1.457 . . . . 0.0 113.706 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -75.7 172.72 15.77 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.913 3.075 . . . . 0.0 113.675 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -53.31 -37.76 62.56 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.851 1.261 . . . . 0.0 113.821 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -53.24 -41.14 65.14 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.024 1.33 . . . . 0.0 112.696 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.6 t -80.47 -42.23 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 124.599 1.16 . . . . 0.0 111.983 174.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -54.81 -39.31 47.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-N 118.593 0.633 . . . . 0.0 110.688 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.3 tptm -61.16 -50.65 72.29 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.079 -1.013 . . . . 0.0 112.137 174.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.6 -50.4 68.15 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.177 0.591 . . . . 0.0 111.816 176.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.44 -50.58 59.47 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.807 0.843 . . . . 0.0 111.9 170.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.15 -47.45 85.86 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.285 0.948 . . . . 0.0 112.819 -176.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -70.96 -32.28 69.1 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.949 -0.47 . . . . 0.0 111.899 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.3 tp -64.35 -49.15 72.81 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.775 0.83 . . . . 0.0 111.516 170.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -66.53 -29.51 69.62 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.926 1.29 . . . . 0.0 114.448 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.6 mttm -54.7 -51.84 64.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 120.062 1.301 . . . . 0.0 112.833 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.95 -17.93 64.59 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.561 1.144 . . . . 0.0 113.687 173.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -108.79 18.65 20.55 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.543 1.937 . . . . 0.0 113.693 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.09 -20.46 65.98 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 120.18 -1.575 . . . . 0.0 113.512 -176.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -103.51 6.76 37.65 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 126.859 2.064 . . . . 0.0 112.991 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -73.73 -172.55 1.28 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.503 1.521 . . . . 0.0 112.704 173.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 m -123.48 170.44 10.38 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 128.098 2.559 . . . . 0.0 110.453 -178.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.7 -56.78 7.89 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.849 1.659 . . . . 0.0 112.637 175.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -68.82 -41.99 5.03 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.212 1.941 . . . . 0.0 113.072 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.53 -41.56 94.68 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.379 -1.451 . . . . 0.0 112.654 -178.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 64.3 mt -69.46 -53.43 24.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 123.588 0.755 . . . . 0.0 109.641 174.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -58.63 -35.39 72.42 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.037 0.835 . . . . 0.0 111.662 -174.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -54.31 -60.9 2.72 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.337 1.455 . . . . 0.0 112.579 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.6 -36.88 85.26 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.074 0.549 . . . . 0.0 112.078 -178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -63.06 -48.97 76.39 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.437 1.095 . . . . 0.0 111.574 174.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -65.23 -34.13 77.63 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 121.568 -0.708 . . . . 0.0 112.363 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.22 -50.87 66.12 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.454 -0.779 . . . . 0.0 112.574 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 7.8 p-90 -73.88 -31.33 63.08 Favored 'General case' 0 CA--C 1.557 1.249 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 170.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.46 -32.48 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 O-C-N 120.243 -1.536 . . . . 0.0 111.813 174.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -59.2 -18.62 38.23 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.583 -0.698 . . . . 0.0 112.366 176.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -97.61 -13.59 21.48 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.861 1.264 . . . . 0.0 113.237 177.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 22.0 mt -62.22 -64.75 0.83 Allowed 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.048 0.84 . . . . 0.0 112.667 174.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.4 117.37 2.64 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.378 0.99 . . . . 0.0 111.657 -177.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 157.22 -169.2 34.23 Favored Glycine 0 CA--C 1.529 0.954 0 C-N-CA 124.922 1.249 . . . . 0.0 112.575 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -59.4 -15.36 16.42 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.336 1.054 . . . . 0.0 113.313 176.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -50.37 -29.38 9.89 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.697 1.999 . . . . 0.0 113.997 174.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.08 -35.8 64.95 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.163 1.385 . . . . 0.0 114.129 172.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.4 -39.54 81.63 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.122 -0.986 . . . . 0.0 111.209 175.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.06 -33.08 75.18 Favored 'General case' 0 C--O 1.22 -0.466 0 O-C-N 121.742 -0.599 . . . . 0.0 110.473 176.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -63.19 -53.22 56.6 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 121.484 -0.76 . . . . 0.0 111.534 173.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.59 -40.56 79.32 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -177.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.3 t -72.17 -39.14 68.89 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -61.52 -52.33 64.93 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.394 -0.816 . . . . 0.0 111.952 176.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 3.3 ttmm -47.88 -46.27 31.33 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 118.329 0.513 . . . . 0.0 111.197 177.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -60.1 -57.17 13.99 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.012 1.325 . . . . 0.0 113.591 173.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -54.16 -49.75 68.57 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.302 0.956 . . . . 0.0 112.301 178.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.02 -48.53 73.58 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.383 1.073 . . . . 0.0 112.075 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -54.73 -39.99 68.8 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.517 0.727 . . . . 0.0 111.556 172.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.25 -51.17 56.34 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.798 0.726 . . . . 0.0 111.454 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -60.35 -48.16 82.96 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.73 0.812 . . . . 0.0 111.027 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -61.24 -49.83 75.53 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.067 1.347 . . . . 0.0 112.089 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.82 -51.63 68.22 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.788 1.176 . . . . 0.0 112.86 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -62.78 -48.36 79.49 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.811 -0.556 . . . . 0.0 112.465 178.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.1 tp -54.46 -51.24 65.63 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.184 0.994 . . . . 0.0 110.955 174.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.78 -42.92 99.61 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.581 1.152 . . . . 0.0 112.072 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -58.17 -50.84 72.11 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.824 1.193 . . . . 0.0 111.466 174.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.34 -47.86 80.42 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.762 0.825 . . . . 0.0 112.713 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -54.5 -56.29 20.37 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.209 1.004 . . . . 0.0 111.068 172.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.82 -40.81 73.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.519 1.128 . . . . 0.0 113.205 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.51 -52.54 65.2 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 171.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.19 -29.76 70.09 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 176.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.6 t -73.13 -26.66 23.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 125.868 1.667 . . . . 0.0 112.678 175.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.56 -34.32 64.64 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.5 pttt -85.03 1.71 46.46 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.286 1.435 . . . . 0.0 114.347 175.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.7 ttm -103.25 -159.27 0.71 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.985 2.114 . . . . 0.0 111.695 -174.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.74 156.71 11.81 Favored Pre-proline 0 N--CA 1.479 1.003 0 C-N-CA 125.283 1.433 . . . . 0.0 113.864 176.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.43 -45.54 1.73 Allowed 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.448 2.765 . . . . 0.0 112.803 -177.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -61.3 -30.71 70.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.147 0.979 . . . . 0.0 112.438 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.76 -48.44 71.82 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.837 0.455 . . . . 0.0 110.23 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.19 -44.62 68.07 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.385 173.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm -59.53 -54.77 42.68 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.034 0.833 . . . . 0.0 110.863 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.08 -49.14 78.81 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.698 -0.626 . . . . 0.0 112.481 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -66.55 -32.94 74.61 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.05 -46.57 80.68 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.663 1.119 . . . . 0.0 111.577 172.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -56.91 -47.06 81.45 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 118.891 0.769 . . . . 0.0 111.662 172.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.6 tp -63.06 -38.75 92.44 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 176.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 21.7 t -71.13 -42.97 68.52 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.69 -1.256 . . . . 0.0 112.256 -178.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.38 -46.11 70.92 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 118.666 -0.683 . . . . 0.0 110.624 175.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.3 tp -66.47 -33.72 65.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 119.263 0.938 . . . . 0.0 111.717 -178.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.04 -32.77 74.45 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -94.31 -28.14 15.73 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 173.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -132.95 78.1 1.77 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.192 1.397 . . . . 0.0 110.964 -172.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -69.88 -32.26 70.52 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.777 -1.202 . . . . 0.0 112.254 -177.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 12.6 t -73.74 -18.81 60.94 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.421 1.489 . . . . 0.0 113.875 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -94.51 84.44 4.32 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.201 1.0 . . . . 0.0 109.266 178.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -92.33 158.17 16.24 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.995 0.918 . . . . 0.0 110.895 170.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 159.34 -87.05 0.11 Allowed Glycine 0 N--CA 1.468 0.811 0 C-N-CA 124.667 1.127 . . . . 0.0 111.79 178.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -55.63 -31.72 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 CA-C-N 118.067 0.934 . . . . 0.0 111.889 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -46.93 -37.72 9.41 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.873 1.269 . . . . 0.0 113.429 -178.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -61.1 -59.42 5.37 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.864 0.866 . . . . 0.0 110.947 172.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -63.81 -33.63 76.1 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.794 0.724 . . . . 0.0 112.285 -177.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.07 -50.99 71.96 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.83 1.252 . . . . 0.0 111.426 173.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.9 -48.47 79.79 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.111 0.964 . . . . 0.0 111.03 173.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 18.4 mm -53.31 -50.59 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 124.378 1.071 . . . . 0.0 111.322 176.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -63.13 -44.44 95.56 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.779 1.172 . . . . 0.0 112.887 176.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.81 -49.0 78.1 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.077 0.951 . . . . 0.0 110.784 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.4 pt -70.49 -38.86 75.2 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 CA-C-O 118.243 -0.884 . . . . 0.0 112.629 173.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -58.17 -39.57 79.23 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 121.006 1.73 . . . . 0.0 113.075 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -67.1 -14.76 63.21 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.824 1.25 . . . . 0.0 113.562 173.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.0 t -132.56 33.34 3.79 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.798 2.039 . . . . 0.0 113.513 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 8.9 mt -108.04 74.86 0.51 Allowed Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 126.174 1.789 . . . . 0.0 109.966 175.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.98 168.39 19.01 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.95 2.433 . . . . 0.0 111.904 173.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -60.53 -27.33 67.54 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.401 -0.812 . . . . 0.0 113.036 173.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 65.6 m -60.46 -51.71 68.32 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.435 1.471 . . . . 0.0 112.381 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.8 p -68.56 -40.15 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.811 -0.556 . . . . 0.0 111.638 175.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 mmtt -58.16 -48.1 81.33 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.502 174.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -69.05 -38.17 78.95 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.674 1.125 . . . . 0.0 113.444 177.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -69.29 -37.09 77.66 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.605 1.093 . . . . 0.0 112.326 177.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.83 -20.82 28.57 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.682 1.193 . . . . 0.0 113.132 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.25 -24.1 10.46 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 126.605 1.962 . . . . 0.0 113.601 177.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.6 tptt -55.66 -29.57 59.53 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.178 1.391 . . . . 0.0 113.371 171.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 85.48 -140.71 18.41 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 125.518 1.533 . . . . 0.0 112.844 -176.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -118.98 64.93 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 126.723 2.009 . . . . 0.0 111.042 -170.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 50.08 74.71 0.25 Allowed Glycine 0 CA--C 1.541 1.672 0 C-N-CA 125.871 1.701 . . . . 0.0 113.352 -174.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -68.52 161.88 43.19 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.42 2.746 . . . . 0.0 112.566 -176.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -143.05 97.91 3.18 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.937 1.295 . . . . 0.0 111.197 -177.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 38.8 t -134.85 131.85 20.22 Favored Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 125.339 1.456 . . . . 0.0 110.121 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -69.86 174.7 9.21 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 123.779 2.986 . . . . 0.0 113.081 176.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 . . . . . 0 C--O 1.25 1.124 0 C-N-CA 126.025 1.73 . . . . 0.0 113.299 -179.131 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 26.3 t0 . . . . . 0 N--CA 1.478 0.955 0 CA-C-O 122.334 1.064 . . . . 0.0 111.751 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 63.58 13.81 7.57 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 126.36 1.864 . . . . 0.0 114.202 -176.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p -121.93 160.01 48.93 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 128.418 2.687 . . . . 0.0 111.905 -173.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -67.45 168.78 17.1 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.017 2.478 . . . . 0.0 112.133 176.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -64.79 118.24 5.24 Favored 'Trans proline' 0 CA--C 1.546 1.081 0 C-N-CA 122.602 2.201 . . . . 0.0 111.079 172.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -69.47 -22.8 32.89 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 CA-C-O 115.381 -2.008 . . . . 0.0 115.995 164.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.89 169.9 20.13 Favored 'Trans proline' 0 C--N 1.363 1.333 0 CA-C-N 124.487 2.638 . . . . 0.0 113.451 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -62.21 121.24 9.17 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.18 2.586 . . . . 0.0 111.975 175.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -56.72 -19.14 15.17 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 171.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.29 36.69 4.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 129.317 3.047 . . . . 0.0 112.415 178.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.16 110.89 0.24 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.401 1.48 . . . . 0.0 113.007 175.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.17 13.11 0.2 Allowed Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.916 1.246 . . . . 0.0 115.766 -174.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -116.76 160.02 38.28 Favored Pre-proline 0 CA--C 1.554 1.114 0 C-N-CA 125.663 1.585 . . . . 0.0 112.67 -170.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -73.82 171.4 17.94 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.423 2.749 . . . . 0.0 113.299 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -55.35 -34.01 63.9 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -53.3 -40.71 64.96 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.249 1.42 . . . . 0.0 112.779 171.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 56.0 t -78.75 -44.18 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 124.508 1.123 . . . . 0.0 111.986 173.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 73.7 t -53.91 -39.52 40.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-N 118.816 0.735 . . . . 0.0 111.211 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 tptm -62.78 -50.45 70.99 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.038 -1.038 . . . . 0.0 112.223 174.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.63 -49.24 71.0 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.258 0.623 . . . . 0.0 111.691 176.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.89 -51.19 58.56 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.29 1.036 . . . . 0.0 111.976 170.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.44 -47.3 86.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.881 1.218 . . . . 0.0 113.312 -177.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -65.7 -40.41 92.25 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.895 -0.503 . . . . 0.0 110.979 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.2 tp -61.66 -46.38 89.99 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.862 0.865 . . . . 0.0 111.524 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -63.16 -40.8 98.58 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.714 -1.241 . . . . 0.0 113.8 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.5 mmtp -56.06 -36.0 67.56 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 119.262 0.937 . . . . 0.0 112.974 174.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.68 -38.35 70.64 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.274 1.43 . . . . 0.0 113.497 173.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -98.3 20.39 12.65 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.538 1.535 . . . . 0.0 113.168 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -66.67 -17.08 64.66 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 119.813 -1.804 . . . . 0.0 113.923 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.0 p -95.35 2.01 54.51 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 127.312 2.245 . . . . 0.0 114.363 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -84.08 179.42 7.51 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.652 1.581 . . . . 0.0 111.163 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.44 170.8 7.73 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.673 1.989 . . . . 0.0 111.068 177.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -47.78 -58.35 7.89 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 124.987 1.315 . . . . 0.0 112.221 175.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.75 -36.85 17.57 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.044 1.829 . . . . 0.0 114.26 178.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.99 -45.08 96.25 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 120.959 -1.088 . . . . 0.0 111.918 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.8 mt -69.46 -48.53 66.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-O 118.665 -0.683 . . . . 0.0 110.552 175.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -52.31 -41.11 62.68 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.244 0.929 . . . . 0.0 111.249 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.64 -50.75 71.3 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.215 1.406 . . . . 0.0 112.63 177.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.09 -43.31 95.62 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.45 0.7 . . . . 0.0 112.278 176.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -63.26 -48.54 77.74 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.727 0.811 . . . . 0.0 110.525 175.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -60.41 -31.27 70.22 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 176.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.16 -51.75 68.67 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.437 -0.789 . . . . 0.0 112.072 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -73.84 -31.22 63.1 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 112.986 0.735 . . . . 0.0 112.986 173.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -57.82 -32.89 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 125.6 1.56 . . . . 0.0 112.993 174.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -57.77 -15.75 9.1 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.24 -14.84 18.3 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.469 1.507 . . . . 0.0 113.549 176.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.4 mt -65.99 -58.04 6.43 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 176.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 75.07 44.7 22.69 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 123.803 0.716 . . . . 0.0 114.712 -177.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -124.96 47.83 1.0 Allowed Glycine 0 N--CA 1.475 1.26 0 C-N-CA 126.178 1.847 . . . . 0.0 113.832 -178.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 69.7 -1.94 2.13 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 128.388 2.675 . . . . 0.0 114.328 -175.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -65.09 -21.31 66.79 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.394 1.478 . . . . 0.0 114.307 -178.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.61 -36.38 56.24 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.674 1.59 . . . . 0.0 113.423 173.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.48 -43.99 75.75 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.66 0.784 . . . . 0.0 111.511 177.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.83 -42.81 94.38 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 118.441 -0.79 . . . . 0.0 111.635 169.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -57.42 -51.87 67.67 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.374 1.443 . . . . 0.0 112.764 175.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.72 -44.85 93.56 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.844 -0.535 . . . . 0.0 112.018 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.2 t -68.35 -38.88 81.91 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 122.816 0.446 . . . . 0.0 112.177 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -66.34 -54.62 22.46 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.729 0.811 . . . . 0.0 111.929 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.7 ttpp -52.82 -43.08 65.71 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.514 0.325 . . . . 0.0 111.48 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.5 mmtt -56.99 -54.3 48.26 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.111 1.764 . . . . 0.0 113.464 170.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -53.48 -46.18 69.9 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.38 0.991 . . . . 0.0 112.499 175.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -61.47 -53.39 57.04 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 121.522 -0.736 . . . . 0.0 112.437 177.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.8 mmtm -55.74 -35.55 66.29 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.2 1.0 . . . . 0.0 111.817 176.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.12 -51.02 42.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.071 0.948 . . . . 0.0 111.034 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.69 -46.4 89.19 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.694 0.798 . . . . 0.0 111.55 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -62.72 -51.71 66.13 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.675 1.19 . . . . 0.0 112.019 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.11 -46.03 86.23 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.039 0.836 . . . . 0.0 112.432 177.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -63.42 -46.67 85.26 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.038 0.935 . . . . 0.0 112.46 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -56.44 -50.97 70.12 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.223 1.009 . . . . 0.0 111.325 171.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.12 -40.47 89.82 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.248 0.619 . . . . 0.0 111.986 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -61.45 -50.23 73.6 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.764 1.226 . . . . 0.0 111.668 175.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.68 -47.05 85.81 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.542 0.61 . . . . 0.0 112.332 177.055 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -57.24 -53.56 56.71 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.922 0.889 . . . . 0.0 111.26 175.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -50.82 -45.69 59.63 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.3 1.44 . . . . 0.0 113.155 174.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.3 -50.87 72.09 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.944 1.298 . . . . 0.0 111.973 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.38 -34.14 77.6 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 172.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.3 t -72.2 -23.46 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 124.927 1.291 . . . . 0.0 112.578 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.03 -31.25 60.95 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.68 -1.263 . . . . 0.0 114.382 175.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.93 -2.79 52.55 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.986 1.314 . . . . 0.0 114.298 176.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.21 -160.27 0.79 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.832 2.053 . . . . 0.0 112.036 -174.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -52.57 155.05 4.08 Favored Pre-proline 0 N--CA 1.479 0.985 0 C-N-CA 126.529 1.932 . . . . 0.0 113.485 171.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -67.05 -49.96 1.21 Allowed 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.296 2.664 . . . . 0.0 112.269 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -61.08 -27.76 68.59 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.967 1.307 . . . . 0.0 113.298 178.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.85 -51.96 62.24 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.913 0.485 . . . . 0.0 110.086 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.2 -42.3 66.15 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.265 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.2 mmtm -60.29 -54.73 42.2 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.564 0.62 . . . . 0.0 110.654 -178.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.38 84.04 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.424 0.689 . . . . 0.0 112.788 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.14 -40.51 86.76 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 177.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.96 -48.35 82.05 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.378 1.071 . . . . 0.0 111.074 171.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.63 -43.76 72.55 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.364 1.066 . . . . 0.0 112.057 173.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.79 -34.59 75.8 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 118.893 0.77 . . . . 0.0 112.866 176.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.9 t -71.96 -43.73 64.72 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.754 -1.216 . . . . 0.0 113.016 177.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -35.5 68.91 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.316 1.046 . . . . 0.0 111.705 176.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 5.6 tt -73.05 -32.73 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 119.253 0.933 . . . . 0.0 111.906 175.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.36 -16.66 37.27 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -116.86 8.63 13.62 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.713 1.605 . . . . 0.0 113.566 175.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.74 136.32 56.8 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.101 -0.999 . . . . 0.0 112.39 175.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -103.07 -46.6 4.59 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.391 1.476 . . . . 0.0 112.916 168.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -124.03 -3.48 8.08 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.638 1.575 . . . . 0.0 114.373 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.69 84.31 4.79 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.361 1.465 . . . . 0.0 110.626 -178.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -95.12 160.93 14.33 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.312 1.045 . . . . 0.0 111.68 176.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 76.98 31.78 51.9 Favored Glycine 0 N--CA 1.475 1.237 0 N-CA-C 115.403 0.921 . . . . 0.0 115.403 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -59.62 -26.96 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 119.339 1.569 . . . . 0.0 113.211 -178.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -47.63 -33.87 7.25 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.297 1.439 . . . . 0.0 113.272 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -59.38 -59.57 5.24 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.797 0.839 . . . . 0.0 111.053 171.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.09 -37.83 88.87 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.19 0.905 . . . . 0.0 111.849 -176.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -53.92 -52.02 61.9 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.67 0.788 . . . . 0.0 111.17 172.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.6 tttt -58.17 -51.78 68.31 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.683 175.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 25.5 mm -49.78 -46.92 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.438 1.095 . . . . 0.0 110.584 178.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -69.16 -42.54 75.78 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.635 0.774 . . . . 0.0 112.795 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.45 -31.99 71.96 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.229 1.412 . . . . 0.0 113.672 174.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 29.3 pt -87.32 -31.31 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 119.113 0.869 . . . . 0.0 112.596 171.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -62.86 -35.56 80.37 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.843 -1.16 . . . . 0.0 111.911 176.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.11 -21.01 66.37 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.35 -0.844 . . . . 0.0 112.802 175.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 7.3 m -77.9 -26.36 49.04 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.844 1.658 . . . . 0.0 112.55 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 40.1 mt -54.22 152.24 11.71 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 123.467 0.707 . . . . 0.0 112.656 172.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.16 159.02 54.12 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.812 2.341 . . . . 0.0 112.474 -176.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -60.35 -24.34 64.99 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 174.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.3 p -63.93 -51.32 64.96 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.691 1.132 . . . . 0.0 112.019 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.4 p -71.88 -39.31 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.853 -0.529 . . . . 0.0 111.576 176.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -56.71 -51.62 68.1 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 118.607 -0.711 . . . . 0.0 112.001 172.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -67.79 -42.38 81.74 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.578 1.081 . . . . 0.0 112.247 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.83 -35.85 81.28 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.115 -0.991 . . . . 0.0 112.546 176.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.18 -19.41 24.25 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.113 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -57.23 -27.89 62.42 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.106 1.762 . . . . 0.0 113.065 176.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 49.9 mmtt -93.59 -4.17 51.33 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.156 1.782 . . . . 0.0 114.144 171.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.09 -112.86 0.82 Allowed Glycine 0 CA--C 1.534 1.231 0 C-N-CA 126.66 2.076 . . . . 0.0 111.291 171.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . 0.267 1.0 OUTLIER 29.37 60.4 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 127.774 2.43 . . . . 0.0 114.677 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 56.32 75.5 0.24 Allowed Glycine 0 CA--C 1.541 1.69 0 C-N-CA 125.502 1.525 . . . . 0.0 113.318 -173.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -71.18 110.2 2.77 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 123.711 2.941 . . . . 0.0 112.686 -171.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -161.94 116.24 1.9 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.886 1.675 . . . . 0.0 110.748 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 39.7 t -97.34 131.96 26.34 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 124.834 1.254 . . . . 0.0 110.219 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -70.56 174.61 9.95 Favored 'Trans proline' 0 CA--C 1.545 1.028 0 C-N-CA 123.728 2.952 . . . . 0.0 113.151 176.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 . . . . . 0 C--O 1.253 1.259 0 C-N-CA 125.159 1.383 . . . . 0.0 113.682 176.678 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 . . . . . 0 CA--C 1.551 0.99 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -62.94 -40.17 96.84 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.483 1.513 . . . . 0.0 114.126 178.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.97 158.1 88.3 Favored Pre-proline 0 N--CA 1.474 0.775 0 C-N-CA 124.984 1.314 . . . . 0.0 112.654 173.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -70.06 162.09 43.51 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 122.642 2.228 . . . . 0.0 111.817 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.85 117.88 4.92 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.859 3.039 . . . . 0.0 111.849 -177.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.14 -21.66 26.93 Favored 'Trans proline' 0 CA--C 1.553 1.467 0 C-N-CA 122.591 2.194 . . . . 0.0 116.654 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.4 167.41 25.36 Favored 'Trans proline' 0 C--N 1.361 1.216 0 CA-C-N 124.241 2.55 . . . . 0.0 112.271 176.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.457 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 33.3 Cg_endo -58.27 133.33 54.43 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.803 2.335 . . . . 0.0 111.752 170.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -49.24 -48.68 45.47 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.397 0.679 . . . . 0.0 111.635 171.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -81.34 18.1 1.2 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 127.128 2.171 . . . . 0.0 115.03 -178.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.36 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.956 2.102 . . . . 0.0 115.467 -172.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.19 24.22 0.1 Allowed Glycine 0 CA--C 1.538 1.502 0 C-N-CA 124.979 1.276 . . . . 0.0 114.758 -173.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -121.76 157.74 56.31 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 125.856 1.662 . . . . 0.0 111.944 -173.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -73.99 169.14 23.11 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.182 2.588 . . . . 0.0 113.205 -177.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -52.09 -41.06 62.1 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.585 1.554 . . . . 0.0 113.275 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -54.22 -42.01 69.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.09 1.356 . . . . 0.0 112.91 173.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.5 t -78.9 -39.24 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.371 1.069 . . . . 0.0 111.503 176.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 46.9 t -57.04 -40.08 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.689 0.795 . . . . 0.0 111.098 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.9 tptt -63.02 -50.63 69.94 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.9 -1.125 . . . . 0.0 111.968 174.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -52.84 -48.42 67.02 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.501 0.72 . . . . 0.0 112.232 174.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.457 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 1.5 t80 -50.66 -53.66 29.24 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.593 1.157 . . . . 0.0 111.964 168.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.35 -47.48 85.86 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -62.11 -42.87 99.67 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.541 0.736 . . . . 0.0 111.166 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.4 tp -58.25 -47.7 82.75 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.522 0.729 . . . . 0.0 111.258 172.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -64.39 -30.75 71.79 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -57.89 -29.97 65.49 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 120.392 1.451 . . . . 0.0 113.279 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -46.34 68.59 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.613 1.165 . . . . 0.0 112.105 169.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -94.16 17.68 12.17 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.336 1.854 . . . . 0.0 114.046 -174.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.76 -25.03 66.2 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 120.044 -1.66 . . . . 0.0 113.316 -172.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.2 p -87.51 -0.48 56.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.555 1.942 . . . . 0.0 114.284 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -81.15 161.1 24.2 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.13 1.372 . . . . 0.0 112.245 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -87.15 171.28 10.8 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.749 2.02 . . . . 0.0 111.651 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -41.91 -59.75 2.39 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 127.487 2.315 . . . . 0.0 113.237 172.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -74.06 -31.34 7.99 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 122.048 1.832 . . . . 0.0 113.578 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.69 -42.84 90.76 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.874 -1.141 . . . . 0.0 111.76 177.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.3 mt -65.97 -53.34 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 123.451 0.7 . . . . 0.0 109.824 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -56.82 -39.16 73.66 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.262 0.937 . . . . 0.0 112.216 -174.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.1 tttm -59.6 -57.41 13.05 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.575 1.15 . . . . 0.0 112.871 177.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -63.18 -38.04 89.6 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.865 -0.522 . . . . 0.0 111.878 -178.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.12 -48.77 77.12 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.62 1.168 . . . . 0.0 111.402 174.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.52 -41.19 72.81 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 121.389 -0.819 . . . . 0.0 113.027 173.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.54 -47.56 73.03 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -176.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 7.4 p-90 -73.99 -36.63 64.53 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 114.59 1.329 . . . . 0.0 114.59 168.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.07 -33.37 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 125.363 1.465 . . . . 0.0 112.326 175.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -59.9 -12.42 7.64 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.055 0.942 . . . . 0.0 112.931 177.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.1 m -109.86 -10.7 14.74 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.767 1.627 . . . . 0.0 112.537 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 16.4 mt -66.86 -52.95 37.48 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 173.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -177.06 -166.76 34.49 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 123.678 0.656 . . . . 0.0 112.797 -163.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -123.44 12.08 8.44 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.603 1.573 . . . . 0.0 114.671 -174.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -106.91 -31.45 8.34 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.67 2.388 . . . . 0.0 112.47 173.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -72.78 -22.2 60.87 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.196 0.998 . . . . 0.0 112.698 176.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -33.77 57.85 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.378 1.471 . . . . 0.0 114.359 171.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.1 -40.03 78.62 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.669 0.788 . . . . 0.0 112.074 178.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.19 -46.37 79.42 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 121.15 -0.969 . . . . 0.0 111.173 169.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -58.23 -48.66 79.68 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 174.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -57.23 -42.81 82.12 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.89 0.768 . . . . 0.0 111.183 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.22 -37.06 66.56 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.032 0.533 . . . . 0.0 112.395 -179.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.97 -47.82 78.91 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.501 1.12 . . . . 0.0 113.212 176.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 19.4 ttpp -56.41 -44.32 80.2 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.965 0.906 . . . . 0.0 111.962 177.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 mttm -58.08 -52.73 64.31 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.639 0.776 . . . . 0.0 112.29 169.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -55.94 -41.64 74.94 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.003 0.82 . . . . 0.0 112.91 177.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 9.8 tmm? -61.79 -51.32 68.75 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 121.514 -0.741 . . . . 0.0 112.542 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -63.82 -28.6 69.97 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.62 0.368 . . . . 0.0 111.399 177.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.43 -51.46 14.87 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.56 1.144 . . . . 0.0 111.916 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.48 -52.67 64.64 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.464 0.575 . . . . 0.0 110.139 174.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.38 -49.19 78.13 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.251 -178.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.36 -46.55 88.15 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.867 1.212 . . . . 0.0 113.064 177.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -66.16 -46.86 75.93 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 118.847 0.749 . . . . 0.0 112.435 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 75.7 mt -57.75 -49.38 76.76 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.463 1.105 . . . . 0.0 110.855 173.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.56 -43.93 96.72 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.188 -0.91 . . . . 0.0 112.233 177.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.7 mtpt -56.21 -50.68 70.57 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.458 1.481 . . . . 0.0 112.421 173.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.49 -51.32 67.92 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 177.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -57.09 -51.99 67.09 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.69 0.796 . . . . 0.0 111.715 175.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.08 -44.62 67.67 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.91 1.284 . . . . 0.0 112.113 176.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -57.18 -52.29 65.9 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.642 0.655 . . . . 0.0 112.583 174.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.31 -30.97 70.95 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 178.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.6 t -72.74 -25.37 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 126.79 2.036 . . . . 0.0 112.913 175.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.44 -30.68 63.15 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.178 1.547 . . . . 0.0 115.178 176.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 pttt -88.73 3.15 51.9 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 125.821 1.648 . . . . 0.0 114.181 172.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 9.1 ttm -106.31 -163.55 0.93 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.695 1.998 . . . . 0.0 111.333 -173.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.15 152.93 20.23 Favored Pre-proline 0 N--CA 1.481 1.091 0 C-N-CA 125.702 1.601 . . . . 0.0 114.209 178.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -68.52 -46.51 1.89 Allowed 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.885 3.057 . . . . 0.0 113.303 -173.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.92 -37.19 71.13 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.411 1.484 . . . . 0.0 112.49 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.0 -46.57 80.88 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.329 0.652 . . . . 0.0 109.828 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -45.39 58.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.418 1.087 . . . . 0.0 111.977 174.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -65.85 -51.62 57.34 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.707 1.203 . . . . 0.0 112.069 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.68 -45.2 92.78 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.167 0.987 . . . . 0.0 113.0 177.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.94 -36.93 70.04 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.065 -1.022 . . . . 0.0 113.234 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.79 97.21 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.496 1.044 . . . . 0.0 111.714 171.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -53.97 -50.51 66.37 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.218 1.407 . . . . 0.0 111.625 170.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 9.6 tp -59.53 -39.69 84.72 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 174.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.5 t -72.62 -38.36 67.8 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.189 -0.945 . . . . 0.0 112.684 -175.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -71.26 -48.66 49.67 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.443 0.697 . . . . 0.0 110.833 174.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.7 tt -67.12 -27.71 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.08 -34.48 70.2 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -79.87 -28.3 39.99 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 171.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -149.05 99.23 2.93 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.302 1.041 . . . . 0.0 113.37 -172.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -64.1 -13.98 51.5 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.6 t -77.23 -5.42 49.22 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.984 1.313 . . . . 0.0 114.139 178.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 87.5 mt -71.97 84.4 0.97 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.944 1.298 . . . . 0.0 111.859 177.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -86.36 177.56 7.42 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.463 1.505 . . . . 0.0 112.738 172.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 85.7 -20.86 16.76 Favored Glycine 0 N--CA 1.473 1.132 0 C-N-CA 125.538 1.542 . . . . 0.0 114.9 177.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -61.41 -24.78 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.884 1.274 . . . . 0.0 112.512 177.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -49.47 -35.97 21.28 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.44 1.496 . . . . 0.0 112.975 174.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -57.12 -59.38 5.17 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.595 1.158 . . . . 0.0 111.48 173.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.96 -36.92 85.94 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.582 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.63 -47.25 80.1 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.709 1.204 . . . . 0.0 110.931 174.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.74 -52.41 62.6 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 117.529 -1.224 . . . . 0.0 112.473 168.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 8.9 mm -52.68 -45.23 48.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 CA-C-N 119.705 1.139 . . . . 0.0 111.678 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -67.37 -45.09 77.31 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.043 0.937 . . . . 0.0 112.018 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.84 -47.37 86.65 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.57 1.148 . . . . 0.0 112.132 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -69.05 -38.62 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.879 -0.513 . . . . 0.0 111.986 173.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -63.83 -28.93 70.19 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.181 1.355 . . . . 0.0 112.859 175.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.1 -11.38 48.47 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 120.083 -1.635 . . . . 0.0 114.224 170.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.92 -7.4 52.19 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 173.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 20.6 mt -48.36 149.94 2.52 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.404 1.482 . . . . 0.0 113.137 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -67.04 165.64 25.66 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.062 2.508 . . . . 0.0 113.251 -173.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 68.5 mm-40 -55.43 -27.84 50.5 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.072 0.949 . . . . 0.0 112.722 176.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.24 -51.69 68.7 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.584 1.154 . . . . 0.0 112.707 176.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -70.96 -46.37 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 O-C-N 121.609 -0.682 . . . . 0.0 109.642 175.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -58.48 -40.96 84.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 118.936 -1.106 . . . . 0.0 110.023 -173.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -65.54 -46.59 78.98 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.109 1.363 . . . . 0.0 112.712 173.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -37.24 79.01 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 119.591 1.087 . . . . 0.0 112.796 179.078 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.2 pp -89.01 -21.53 23.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.491 0.716 . . . . 0.0 112.825 -179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -58.63 -23.72 59.56 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.814 1.646 . . . . 0.0 113.839 176.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.4 -26.96 44.74 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.945 1.298 . . . . 0.0 112.23 168.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 50.55 -134.69 29.55 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.555 1.074 . . . . 0.0 111.845 -175.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.2 pp -143.22 49.21 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 126.166 1.786 . . . . 0.0 111.8 -174.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 56.81 76.86 0.18 Allowed Glycine 0 CA--C 1.54 1.656 0 C-N-CA 126.63 2.062 . . . . 0.0 112.617 -178.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -73.46 170.89 18.86 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.492 2.795 . . . . 0.0 112.96 -174.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -135.08 74.18 1.51 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.892 1.677 . . . . 0.0 110.927 -177.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 22.9 t -142.65 133.15 12.46 Favored Pre-proline 0 N--CA 1.481 1.082 0 C-N-CA 126.164 1.785 . . . . 0.0 109.581 177.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -72.4 -179.91 4.48 Favored 'Trans proline' 0 CA--C 1.547 1.137 0 C-N-CA 123.821 3.014 . . . . 0.0 113.097 174.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 47.9 tp60 . . . . . 0 C--O 1.252 1.215 0 C-N-CA 125.037 1.335 . . . . 0.0 113.069 177.555 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.545 0.763 0 CA-C-O 120.926 0.394 . . . . 0.0 112.042 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -158.69 55.47 0.43 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.61 1.564 . . . . 0.0 112.609 -176.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.21 162.92 40.43 Favored Pre-proline 0 N--CA 1.478 0.945 0 C-N-CA 124.641 1.176 . . . . 0.0 112.131 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -70.15 118.15 5.52 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 123.161 2.574 . . . . 0.0 110.461 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -75.92 114.78 4.0 Favored 'Trans proline' 0 CA--C 1.547 1.133 0 C-N-CA 122.975 2.45 . . . . 0.0 112.878 -177.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -68.53 -21.85 39.33 Favored 'Trans proline' 0 CA--C 1.554 1.499 0 N-CA-C 116.977 1.876 . . . . 0.0 116.977 170.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.89 166.98 27.22 Favored 'Trans proline' 0 C--N 1.362 1.269 0 CA-C-N 124.264 2.559 . . . . 0.0 112.882 176.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.16 148.08 84.63 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.073 2.516 . . . . 0.0 112.543 175.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -61.18 -24.66 66.47 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -112.57 32.87 5.31 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.869 2.468 . . . . 0.0 111.629 177.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.18 116.55 0.84 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.86 1.264 . . . . 0.0 113.148 171.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.99 -11.53 2.85 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 126.362 1.934 . . . . 0.0 113.629 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.97 158.89 52.57 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.809 1.644 . . . . 0.0 112.453 -178.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.65 174.18 12.67 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.821 2.348 . . . . 0.0 113.609 -178.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -52.09 -35.72 48.68 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.49 1.516 . . . . 0.0 113.094 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -52.9 -41.26 64.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.459 1.503 . . . . 0.0 113.178 172.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 69.7 t -80.75 -41.24 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.488 1.115 . . . . 0.0 111.828 175.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 43.2 t -56.58 -37.82 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.382 0.673 . . . . 0.0 111.299 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.2 tptt -62.12 -50.69 70.88 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.352 -0.842 . . . . 0.0 112.312 172.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.27 -46.8 76.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.523 0.729 . . . . 0.0 111.532 177.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -51.78 -53.8 35.78 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.678 1.191 . . . . 0.0 111.747 168.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.25 -47.45 83.52 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.671 1.123 . . . . 0.0 113.925 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.74 -41.33 96.01 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.155 0.582 . . . . 0.0 111.621 178.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.9 tp -60.16 -44.99 94.58 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.21 0.604 . . . . 0.0 111.42 172.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -61.7 -38.82 89.25 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.513 1.925 . . . . 0.0 114.012 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -54.25 -31.1 52.63 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 174.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -68.65 -44.96 73.03 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.193 0.997 . . . . 0.0 112.399 175.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -101.41 26.99 6.62 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.741 2.016 . . . . 0.0 112.606 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -24.95 43.79 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.903 1.281 . . . . 0.0 113.918 -179.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.81 -30.53 64.14 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.297 1.839 . . . . 0.0 113.262 176.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.5 mmtt -65.85 142.86 57.78 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.335 1.054 . . . . 0.0 110.212 176.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.59 158.25 34.38 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.464 0.706 . . . . 0.0 109.465 171.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -37.96 -58.99 1.27 Allowed Pre-proline 0 CA--C 1.552 1.056 0 CA-C-O 117.242 -1.361 . . . . 0.0 113.956 173.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -57.98 -44.25 41.49 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.012 3.141 . . . . 0.0 114.536 177.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -58.97 -39.01 80.42 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.922 0.889 . . . . 0.0 111.755 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 25.0 mt -66.07 -47.4 85.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 124.026 0.931 . . . . 0.0 110.362 173.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -52.26 -39.01 59.83 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.15 -57.35 9.88 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 122.091 0.948 . . . . 0.0 113.164 170.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -32.49 74.0 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.284 -0.885 . . . . 0.0 112.551 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.433 HD11 ' HE1' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -62.31 -49.97 73.51 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.015 1.326 . . . . 0.0 110.77 170.942 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -54.66 -35.53 63.62 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.893 0.877 . . . . 0.0 113.131 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.36 45.04 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.433 ' HE1' HD11 ' A' ' 40' ' ' LEU . 9.7 p-90 -73.79 -33.83 64.39 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 174.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -57.74 -31.57 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.401 1.48 . . . . 0.0 111.656 174.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -57.8 -17.84 18.32 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.383 0.992 . . . . 0.0 112.82 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.68 -11.32 23.64 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.172 1.389 . . . . 0.0 113.223 176.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.5 mt -66.25 -71.21 0.2 Allowed 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 119.079 0.854 . . . . 0.0 112.618 171.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 79.3 99.05 0.26 Allowed Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.431 1.015 . . . . 0.0 112.699 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.16 -171.7 40.97 Favored Glycine 0 CA--C 1.533 1.208 0 C-N-CA 124.39 0.995 . . . . 0.0 113.03 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 57.2 m-20 -58.63 -18.29 29.26 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.369 1.468 . . . . 0.0 113.57 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -52.01 -24.33 6.47 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.748 2.019 . . . . 0.0 113.78 170.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.457 ' HA ' ' CD2' ' A' ' 55' ' ' PHE . 9.1 ptmt -44.84 -41.2 6.84 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.475 1.51 . . . . 0.0 113.712 172.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.34 -43.19 82.15 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.359 1.064 . . . . 0.0 112.953 177.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.55 -45.04 77.32 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.014 -1.054 . . . . 0.0 110.484 169.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.457 ' CD2' ' HA ' ' A' ' 52' ' ' LYS . 3.6 m-30 -60.87 -43.92 97.77 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.46 1.027 . . . . 0.0 112.49 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -60.33 -44.2 95.72 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 118.416 0.553 . . . . 0.0 111.762 177.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.93 -38.19 66.91 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.083 0.553 . . . . 0.0 112.486 -178.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -65.78 -48.63 71.15 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.351 1.061 . . . . 0.0 112.7 176.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -43.57 75.27 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.003 0.365 . . . . 0.0 111.255 177.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? -58.28 -54.03 51.57 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.08 1.752 . . . . 0.0 112.967 172.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -53.28 -47.51 69.1 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.222 0.919 . . . . 0.0 112.064 175.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -59.78 -53.41 58.25 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 123.742 0.817 . . . . 0.0 112.451 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.5 mttm -57.36 -34.47 68.84 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.216 1.006 . . . . 0.0 112.195 175.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.01 -51.38 32.77 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.882 0.873 . . . . 0.0 111.747 178.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.34 -52.45 65.3 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.321 1.048 . . . . 0.0 110.388 176.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -61.31 -49.84 75.4 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.202 1.001 . . . . 0.0 111.951 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.61 -48.72 78.65 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.511 1.505 . . . . 0.0 112.753 177.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -62.44 -53.96 47.23 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.184 0.594 . . . . 0.0 111.988 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.5 tp -54.09 -51.27 64.68 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.08 1.352 . . . . 0.0 110.354 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.81 -48.19 82.14 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 124.119 0.968 . . . . 0.0 111.393 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.96 -50.59 68.52 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 120.747 1.612 . . . . 0.0 112.315 176.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.0 -50.89 71.97 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.628 0.771 . . . . 0.0 112.666 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -58.76 -48.96 79.41 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.746 1.219 . . . . 0.0 110.932 178.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -54.38 -44.31 72.17 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.606 1.962 . . . . 0.0 112.539 174.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -59.02 -50.54 73.71 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.472 0.709 . . . . 0.0 112.014 175.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.19 -38.16 90.07 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 121.221 0.534 . . . . 0.0 112.286 175.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.8 t -69.02 -27.56 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 C-N-CA 125.84 1.656 . . . . 0.0 112.868 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.18 -22.04 6.0 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 174.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.2 pttt -116.45 1.52 12.99 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.96 1.704 . . . . 0.0 114.566 174.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 31.9 tpp -86.56 -83.86 0.18 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.754 1.621 . . . . 0.0 111.175 -177.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.7 150.72 76.57 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 127.579 2.351 . . . . 0.0 112.452 -175.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -71.22 -49.7 0.36 Allowed 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 123.899 3.066 . . . . 0.0 113.372 -176.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.4 -37.97 89.4 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.857 1.263 . . . . 0.0 112.2 177.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.69 -36.06 82.61 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.316 0.646 . . . . 0.0 110.774 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.73 -48.32 66.77 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.087 0.955 . . . . 0.0 111.603 173.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 mttm -63.92 -53.3 52.54 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.238 1.015 . . . . 0.0 111.199 177.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -53.46 -55.49 24.83 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.281 0.632 . . . . 0.0 112.275 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -67.79 -37.67 82.34 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.718 0.807 . . . . 0.0 112.67 -176.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.5 -49.41 77.66 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.398 -0.814 . . . . 0.0 111.076 172.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.21 -41.02 87.61 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.464 1.106 . . . . 0.0 112.526 175.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 7.5 mp -66.88 -38.93 87.22 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 119.352 0.978 . . . . 0.0 112.608 172.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.5 t -71.4 -42.63 68.1 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 120.473 -1.392 . . . . 0.0 113.022 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -49.56 68.42 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.324 0.65 . . . . 0.0 109.614 174.114 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.8 tp -65.46 -28.14 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -178.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.61 -26.87 68.26 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 177.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -104.66 -27.34 11.88 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.379 1.071 . . . . 0.0 113.173 173.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -89.69 82.78 6.26 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.503 1.521 . . . . 0.0 113.134 -178.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -73.38 -24.45 60.31 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 120.351 -1.468 . . . . 0.0 113.967 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.1 t -75.97 -17.87 59.54 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.36 1.064 . . . . 0.0 113.793 -178.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -79.87 164.3 23.68 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.836 1.654 . . . . 0.0 112.166 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 24.5 p30 -71.94 170.8 13.0 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.2 1.0 . . . . 0.0 113.063 174.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -77.83 53.43 3.69 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 125.417 1.484 . . . . 0.0 114.078 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.94 -28.78 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.933 1.293 . . . . 0.0 112.885 -177.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -43.71 -35.8 1.97 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.502 1.521 . . . . 0.0 114.032 170.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -60.95 -59.38 5.46 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.599 0.76 . . . . 0.0 111.536 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.11 -31.54 72.79 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.831 0.741 . . . . 0.0 111.892 -176.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.36 -52.33 65.71 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.451 0.301 . . . . 0.0 111.445 172.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -54.67 -46.87 74.1 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 117.91 -1.043 . . . . 0.0 111.646 174.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 27.4 mm -52.97 -49.81 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.355 1.062 . . . . 0.0 111.731 174.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 68.6 mm-40 -64.41 -46.22 84.21 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.064 1.302 . . . . 0.0 112.947 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.39 -48.9 77.84 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.124 0.969 . . . . 0.0 111.725 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.59 -40.09 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.161 173.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -58.79 -37.87 77.29 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.304 1.411 . . . . 0.0 113.439 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 50.8 mttm -63.34 -17.41 62.55 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 173.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 4.8 t -119.93 24.42 10.53 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.356 1.862 . . . . 0.0 113.199 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.69 71.29 2.45 Favored Pre-proline 0 CA--C 1.552 1.033 0 C-N-CA 126.253 1.821 . . . . 0.0 110.643 177.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.6 166.93 24.2 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.013 2.475 . . . . 0.0 112.188 174.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -60.89 -24.66 66.15 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 174.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 71.5 m -62.7 -51.61 66.54 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 120.009 1.277 . . . . 0.0 112.044 176.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.6 p -70.22 -38.94 76.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 121.905 -0.497 . . . . 0.0 111.137 176.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.2 tttt -61.21 -45.69 93.52 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.109 0.868 . . . . 0.0 112.071 177.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -69.87 -39.43 76.32 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.057 0.943 . . . . 0.0 113.05 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -67.54 -36.74 81.56 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.199 -0.938 . . . . 0.0 112.412 176.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.23 -19.44 31.64 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.351 1.06 . . . . 0.0 113.26 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -54.59 -26.87 35.18 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.951 1.7 . . . . 0.0 113.833 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.94 -21.06 66.31 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.978 1.711 . . . . 0.0 113.233 172.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 60.76 -134.99 49.48 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.606 1.574 . . . . 0.0 112.822 -177.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -128.92 62.29 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 126.49 1.916 . . . . 0.0 110.777 -171.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 50.85 74.81 0.25 Allowed Glycine 0 CA--C 1.541 1.686 0 C-N-CA 126.462 1.982 . . . . 0.0 113.138 -173.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -71.79 95.94 0.74 Allowed 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 124.38 3.387 . . . . 0.0 111.96 -171.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 57.28 107.47 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 127.116 2.166 . . . . 0.0 113.263 -168.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 7.4 p -107.22 79.3 0.71 Allowed Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.518 1.527 . . . . 0.0 111.689 174.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -72.78 -12.09 26.26 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.321 2.681 . . . . 0.0 114.357 179.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . 0.298 13.8 pt20 . . . . . 0 C--O 1.253 1.268 1 C-N-CA 132.297 4.239 . . . . 0.0 118.194 -179.527 . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.548 0.892 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.8 -63.19 1.11 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.664 1.186 . . . . 0.0 112.372 178.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.3 158.46 86.72 Favored Pre-proline 0 N--CA 1.471 0.609 0 C-N-CA 124.407 1.083 . . . . 0.0 111.632 174.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -69.81 165.16 31.94 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.589 2.193 . . . . 0.0 111.799 177.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.59 116.46 3.66 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.647 2.898 . . . . 0.0 111.399 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -68.67 -23.06 36.76 Favored 'Trans proline' 0 CA--C 1.551 1.335 0 CA-C-O 115.882 -1.799 . . . . 0.0 115.511 167.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.02 160.47 49.22 Favored 'Trans proline' 0 C--N 1.363 1.314 0 CA-C-N 124.122 2.508 . . . . 0.0 112.537 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -64.87 130.14 25.24 Favored 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 123.54 2.827 . . . . 0.0 111.454 174.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -52.1 -49.78 62.92 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.125 -0.984 . . . . 0.0 112.505 174.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.16 -2.07 17.33 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -15.48 99.12 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.782 2.833 . . . . 0.0 115.192 -175.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 162.61 -21.69 0.19 Allowed Glycine 0 CA--C 1.537 1.413 0 C-N-CA 124.549 1.071 . . . . 0.0 114.98 -177.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.17 161.56 72.63 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 124.54 1.136 . . . . 0.0 113.135 176.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.47 172.67 15.67 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.438 2.758 . . . . 0.0 113.991 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -52.84 -36.34 58.66 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.991 1.316 . . . . 0.0 113.33 -179.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -54.05 -39.91 66.64 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.513 1.525 . . . . 0.0 112.7 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 72.3 t -83.29 -39.87 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.536 1.534 . . . . 0.0 111.754 176.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 59.4 t -55.9 -39.72 58.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.066 0.946 . . . . 0.0 111.022 177.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 tptm -60.57 -50.64 72.74 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.718 0.807 . . . . 0.0 111.935 172.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.78 -47.15 74.32 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.672 0.669 . . . . 0.0 111.945 178.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -53.48 -53.47 51.03 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.459 1.104 . . . . 0.0 112.06 168.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.21 -47.42 83.51 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 119.086 0.857 . . . . 0.0 113.136 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.15 -37.65 88.07 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.793 0.837 . . . . 0.0 112.054 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.9 tp -60.57 -52.55 64.67 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.559 0.744 . . . . 0.0 111.193 171.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -71.28 -27.34 63.36 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.019 1.328 . . . . 0.0 113.601 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.5 mmtt -52.48 -48.07 66.15 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.029 1.731 . . . . 0.0 112.687 173.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 tttt -67.08 -24.03 65.92 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 178.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -109.75 30.48 6.64 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.32 2.248 . . . . 0.0 112.46 178.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -54.83 -23.3 17.68 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 119.976 -1.703 . . . . 0.0 113.917 -173.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.7 p -77.08 8.17 4.19 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.715 2.806 . . . . 0.0 114.989 172.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.09 171.95 0.23 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.25 1.82 . . . . 0.0 114.112 170.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 m -138.17 170.07 16.68 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 127.773 2.429 . . . . 0.0 109.409 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -40.14 -56.76 3.17 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 127.335 2.254 . . . . 0.0 113.436 175.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.64 -36.51 14.36 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 122.51 2.14 . . . . 0.0 113.856 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.93 -40.91 95.76 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.556 1.071 . . . . 0.0 111.064 178.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 22.6 mt -62.57 -53.39 47.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.44 -38.45 91.17 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 119.017 -1.073 . . . . 0.0 111.909 -175.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.7 ttmt -65.19 -60.17 3.29 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 125.103 1.361 . . . . 0.0 112.138 177.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -59.41 -38.62 81.07 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.678 0.672 . . . . 0.0 112.197 -179.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.22 -51.15 60.46 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.474 176.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -59.01 -33.3 70.56 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.99 -52.17 65.14 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 8.7 p-90 -73.91 -35.02 64.59 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 114.376 1.251 . . . . 0.0 114.376 169.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -57.6 -27.8 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 O-C-N 120.266 -1.521 . . . . 0.0 111.795 176.085 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -56.17 -25.75 47.86 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.775 0.83 . . . . 0.0 112.501 176.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 38.7 p -88.65 -20.97 24.22 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 41.3 mt -64.77 -62.13 1.76 Allowed 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 118.433 0.56 . . . . 0.0 111.909 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 75.85 93.79 0.18 Allowed Glycine 0 CA--C 1.532 1.124 0 C-N-CA 124.728 1.156 . . . . 0.0 112.544 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.71 -165.33 29.58 Favored Glycine 0 CA--C 1.53 0.99 0 C-N-CA 124.792 1.187 . . . . 0.0 112.307 -177.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.7 -13.28 5.55 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.11 1.364 . . . . 0.0 113.907 177.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -52.94 -24.68 9.81 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.527 1.931 . . . . 0.0 113.635 174.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt -53.01 -36.11 60.14 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.389 1.476 . . . . 0.0 114.203 170.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.7 -43.26 80.52 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.099 0.96 . . . . 0.0 111.475 176.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.53 -41.53 90.25 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.688 -0.632 . . . . 0.0 111.419 170.075 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -58.99 -50.28 74.68 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 119.797 1.18 . . . . 0.0 112.365 175.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.65 -45.31 92.38 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 118.106 0.412 . . . . 0.0 111.814 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.3 t -66.97 -43.18 83.71 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -65.51 -54.01 34.23 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.437 0.695 . . . . 0.0 112.114 177.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -49.76 -46.43 50.54 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.907 0.883 . . . . 0.0 111.584 177.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -57.49 -55.71 31.27 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.173 1.389 . . . . 0.0 113.269 172.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -55.01 -44.03 74.19 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 118.89 0.768 . . . . 0.0 112.726 176.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.72 -53.31 56.32 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.525 1.13 . . . . 0.0 112.917 176.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 6.2 mtpp -56.66 -36.17 69.25 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 119.053 -0.499 . . . . 0.0 111.847 174.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.14 -49.9 52.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.814 0.846 . . . . 0.0 111.673 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.9 tttt -58.95 -51.16 71.24 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.412 1.085 . . . . 0.0 110.827 177.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.94 -50.1 74.78 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.682 1.193 . . . . 0.0 112.134 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.52 -49.97 71.18 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.179 0.9 . . . . 0.0 113.118 176.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -63.96 -47.11 81.71 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.465 0.706 . . . . 0.0 112.505 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.6 mt -56.46 -46.79 80.19 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.897 0.879 . . . . 0.0 112.032 173.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.25 -48.43 81.49 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.273 1.029 . . . . 0.0 111.182 177.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -50.87 67.41 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 119.963 1.256 . . . . 0.0 112.039 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.61 -48.92 75.38 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.376 0.67 . . . . 0.0 112.345 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.9 m80 -55.51 -54.09 48.29 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.961 0.904 . . . . 0.0 111.515 173.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -54.52 -41.04 69.21 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.897 1.679 . . . . 0.0 112.673 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -51.3 69.34 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.822 0.849 . . . . 0.0 111.935 174.058 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.07 -29.29 69.03 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 175.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 63.8 t -73.02 -28.44 26.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.65 1.98 . . . . 0.0 112.286 175.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.86 -36.36 58.9 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 174.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -90.98 2.17 56.49 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.642 1.577 . . . . 0.0 113.987 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 3.9 ttm -97.43 -77.02 0.5 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.421 1.488 . . . . 0.0 111.519 -174.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.71 149.56 73.33 Favored Pre-proline 0 N--CA 1.481 1.122 0 C-N-CA 126.285 1.834 . . . . 0.0 112.806 -176.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.24 -46.53 0.66 Allowed 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.768 2.978 . . . . 0.0 113.184 -177.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -68.02 -33.06 73.87 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.565 1.146 . . . . 0.0 112.523 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.59 76.04 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.915 0.486 . . . . 0.0 111.228 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.11 -51.77 65.36 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.857 0.753 . . . . 0.0 110.594 169.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -57.27 -54.7 43.82 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.513 1.125 . . . . 0.0 110.849 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.48 -52.53 65.2 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.22 -34.86 78.98 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.352 0.661 . . . . 0.0 112.432 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.3 -48.12 76.85 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 119.716 1.143 . . . . 0.0 110.774 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.25 -45.68 76.08 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.051 0.941 . . . . 0.0 112.34 171.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 8.3 tp -63.1 -39.14 93.82 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 118.836 0.744 . . . . 0.0 112.67 174.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.0 t -71.92 -41.72 67.54 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 120.603 -1.31 . . . . 0.0 112.238 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.61 -42.49 78.06 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.283 0.633 . . . . 0.0 110.869 176.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.9 tp -70.07 -31.46 47.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 118.46 0.573 . . . . 0.0 112.311 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.09 -31.7 72.17 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -81.59 -12.83 58.61 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 172.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -158.15 95.71 1.39 Allowed 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 119.882 1.219 . . . . 0.0 113.533 -171.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.72 -8.63 57.65 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 58.8 m -80.99 -0.06 37.83 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.638 1.575 . . . . 0.0 114.666 178.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 6.3 mp -69.89 172.44 7.73 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.33 1.452 . . . . 0.0 112.694 175.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -69.34 177.68 2.72 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.197 1.399 . . . . 0.0 111.78 173.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.88 55.62 3.05 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.642 1.591 . . . . 0.0 113.881 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.74 -27.46 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 124.654 1.182 . . . . 0.0 112.788 -177.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -47.96 -34.19 8.84 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.508 1.523 . . . . 0.0 113.536 172.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -59.2 5.77 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 118.775 0.716 . . . . 0.0 111.304 173.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.89 79.23 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.538 0.735 . . . . 0.0 112.488 -179.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -53.91 -52.23 61.2 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.421 1.088 . . . . 0.0 110.714 169.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -49.61 75.54 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 117.631 -1.176 . . . . 0.0 111.509 175.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.5 mm -54.21 -49.58 61.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 119.53 1.059 . . . . 0.0 111.501 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 69.5 mm-40 -62.06 -44.74 96.03 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.301 -0.874 . . . . 0.0 112.369 176.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.61 -48.95 78.58 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 119.131 0.878 . . . . 0.0 112.329 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -67.15 -35.76 75.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.514 0.725 . . . . 0.0 111.85 176.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -69.78 -32.61 71.19 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.881 0.872 . . . . 0.0 112.947 175.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.7 mmtm -68.43 -24.17 64.71 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 119.75 -1.844 . . . . 0.0 112.079 175.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.4 t -98.93 44.22 1.03 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.296 1.439 . . . . 0.0 112.78 173.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 2.4 mt -50.33 145.1 10.74 Favored Pre-proline 0 N--CA 1.478 0.94 0 O-C-N 120.625 -1.297 . . . . 0.0 112.005 172.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -64.81 160.02 42.83 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 122.945 2.43 . . . . 0.0 112.645 -176.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -61.45 -27.6 68.68 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.538 -0.726 . . . . 0.0 112.174 177.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 22.7 t -61.14 -51.69 68.01 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.641 1.109 . . . . 0.0 112.129 177.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.2 p -74.99 -38.76 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.612 -0.68 . . . . 0.0 111.804 178.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -56.98 -51.15 70.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.626 171.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -63.95 -43.52 95.57 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.015 1.28 . . . . 0.0 112.699 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -66.51 -34.43 77.89 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.256 0.935 . . . . 0.0 112.804 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.34 -23.88 24.46 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.207 1.003 . . . . 0.0 113.242 178.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -55.76 -24.71 37.01 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 126.472 1.909 . . . . 0.0 113.187 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 8.5 tmtm? -52.71 -39.58 62.17 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 125.145 1.378 . . . . 0.0 111.735 172.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 41.64 -131.85 3.89 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.828 1.68 . . . . 0.0 111.848 -178.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.1 pp -151.16 54.93 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 126.087 1.755 . . . . 0.0 111.397 -176.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 51.17 74.77 0.26 Allowed Glycine 0 CA--C 1.541 1.688 0 C-N-CA 125.998 1.761 . . . . 0.0 113.587 -176.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -70.43 -27.21 23.57 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.41 2.74 . . . . 0.0 114.359 -170.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 41.32 58.27 2.68 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 127.31 2.244 . . . . 0.0 114.314 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 14.6 p -70.91 133.97 85.93 Favored Pre-proline 0 N--CA 1.473 0.721 0 C-N-CA 124.904 1.282 . . . . 0.0 111.156 179.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -73.06 -169.26 0.49 Allowed 'Trans proline' 0 CA--C 1.549 1.232 0 C-N-CA 123.656 2.904 . . . . 0.0 112.597 174.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.239 0 C-N-CA 126.145 1.778 . . . . 0.0 112.664 -177.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 16.2 t70 . . . . . 0 CA--C 1.548 0.885 0 CA-C-O 120.846 0.355 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -157.65 -174.91 5.09 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.382 1.073 . . . . 0.0 112.642 175.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 p -56.52 158.44 8.14 Favored Pre-proline 0 N--CA 1.483 1.195 0 C-N-CA 124.319 1.048 . . . . 0.0 113.115 171.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -67.96 162.71 38.67 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 122.558 2.172 . . . . 0.0 112.277 178.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -63.46 117.63 4.58 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.445 2.763 . . . . 0.0 111.437 -179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -71.6 -21.3 25.82 Favored 'Trans proline' 0 CA--C 1.553 1.433 0 CA-C-O 115.714 -1.869 . . . . 0.0 116.287 167.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.83 165.98 29.22 Favored 'Trans proline' 0 C--N 1.362 1.275 0 CA-C-N 124.36 2.593 . . . . 0.0 112.356 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.441 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 35.2 Cg_endo -58.77 131.5 42.45 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.52 2.146 . . . . 0.0 111.019 169.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -49.89 -49.6 49.01 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.999 0.52 . . . . 0.0 110.734 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -80.24 28.54 0.3 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.671 1.988 . . . . 0.0 115.081 176.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -40.32 107.62 0.07 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.494 1.518 . . . . 0.0 114.297 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.55 17.11 0.3 Allowed Glycine 0 CA--C 1.537 1.466 0 C-N-CA 124.784 1.183 . . . . 0.0 115.044 -174.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.67 158.23 36.15 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.842 1.657 . . . . 0.0 112.132 -173.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -73.0 167.18 28.05 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.778 2.319 . . . . 0.0 112.732 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -53.78 -38.74 64.78 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.61 1.164 . . . . 0.0 113.093 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.96 -40.14 63.48 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.586 1.554 . . . . 0.0 112.825 173.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.9 t -82.75 -39.71 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.029 1.332 . . . . 0.0 111.713 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.8 t -56.03 -40.25 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.863 0.756 . . . . 0.0 110.955 176.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.4 tptt -61.26 -50.52 72.7 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.081 -1.012 . . . . 0.0 111.866 174.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.0 75.01 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.43 0.692 . . . . 0.0 112.025 178.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.441 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 1.5 t80 -52.82 -53.75 44.11 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.728 1.211 . . . . 0.0 112.273 168.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.66 -47.37 85.9 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.646 1.112 . . . . 0.0 113.579 -178.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -61.15 -38.77 87.62 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.849 0.86 . . . . 0.0 111.407 176.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.5 tp -64.15 -47.69 78.92 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 121.819 -0.55 . . . . 0.0 111.465 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.61 -35.52 76.32 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.576 1.55 . . . . 0.0 114.26 -178.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.22 -31.0 61.12 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.348 1.431 . . . . 0.0 113.025 175.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -70.38 -36.43 74.11 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.721 1.608 . . . . 0.0 112.507 176.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -109.81 20.18 18.31 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.438 1.895 . . . . 0.0 112.375 -176.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -26.1 66.6 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.053 -1.654 . . . . 0.0 113.5 -175.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 33.0 p -85.27 -0.32 54.33 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.659 2.384 . . . . 0.0 114.379 177.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -82.69 167.91 17.76 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 125.418 1.487 . . . . 0.0 112.609 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.21 171.52 9.44 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.926 2.09 . . . . 0.0 111.94 178.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -46.04 -61.16 2.73 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 126.746 2.018 . . . . 0.0 112.595 172.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.35 -38.32 20.75 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 121.894 1.729 . . . . 0.0 112.744 177.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -42.07 99.35 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 120.444 -1.41 . . . . 0.0 112.684 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.1 mt -68.18 -53.34 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 124.25 1.02 . . . . 0.0 110.385 173.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -56.9 -37.62 71.67 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.368 0.986 . . . . 0.0 112.468 -174.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -59.47 -56.99 15.07 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.146 1.378 . . . . 0.0 111.919 177.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -65.59 -35.2 80.15 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.688 0.395 . . . . 0.0 111.919 -178.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -61.32 -51.07 70.4 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.053 1.341 . . . . 0.0 112.229 170.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -60.71 -36.94 80.07 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.25 -0.906 . . . . 0.0 112.862 177.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.34 -49.16 72.95 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 8.2 p-90 -73.7 -35.59 65.15 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 170.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -56.63 -31.59 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 125.393 1.477 . . . . 0.0 112.229 175.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -57.6 -19.61 27.16 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 119.027 0.831 . . . . 0.0 112.906 176.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.7 -15.35 23.98 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.119 1.367 . . . . 0.0 113.727 174.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 48.7 mt -67.76 -65.59 0.67 Allowed 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 118.924 0.784 . . . . 0.0 112.453 174.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 76.88 91.27 0.25 Allowed Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.163 0.887 . . . . 0.0 112.621 -178.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -175.39 -164.25 29.63 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.093 1.33 . . . . 0.0 112.348 -176.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -58.05 -15.38 9.07 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.996 1.318 . . . . 0.0 113.738 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -53.07 -25.41 12.66 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.612 2.365 . . . . 0.0 113.984 174.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -52.3 -39.48 60.57 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.968 1.707 . . . . 0.0 113.221 171.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.59 -52.04 59.61 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.229 1.012 . . . . 0.0 110.532 176.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.88 -46.03 71.24 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.579 -0.701 . . . . 0.0 111.367 176.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -54.76 -49.14 71.59 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 173.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.03 -47.97 79.63 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 119.129 0.877 . . . . 0.0 111.531 179.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -48.71 80.59 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.075 1.35 . . . . 0.0 113.298 177.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -61.01 -53.02 62.38 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.519 1.128 . . . . 0.0 111.695 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -54.09 -46.45 72.08 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.888 0.875 . . . . 0.0 111.811 177.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.6 mttt -55.82 -53.03 61.64 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.069 0.948 . . . . 0.0 112.361 172.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -55.78 -42.84 76.11 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.887 0.875 . . . . 0.0 112.639 177.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -61.61 -53.34 57.52 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.897 0.879 . . . . 0.0 112.869 176.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt -60.67 -32.29 71.5 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 118.997 -0.525 . . . . 0.0 111.82 175.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.34 -51.61 35.3 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.796 0.838 . . . . 0.0 111.15 178.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.8 ttmt -61.06 -48.1 83.29 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.214 0.461 . . . . 0.0 110.593 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.94 -51.82 68.06 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.578 1.151 . . . . 0.0 112.707 177.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.67 -43.75 90.01 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.782 1.174 . . . . 0.0 112.858 177.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -63.22 -50.45 70.19 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.656 0.782 . . . . 0.0 112.022 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.3 mt -57.1 -50.81 71.63 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.113 0.965 . . . . 0.0 111.171 176.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.42 -45.33 84.74 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.991 0.917 . . . . 0.0 112.283 175.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -59.04 -50.78 72.79 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-N 120.766 1.621 . . . . 0.0 111.781 177.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.28 75.81 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -56.63 -52.28 65.46 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.932 0.893 . . . . 0.0 110.699 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.45 -41.61 73.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.973 1.309 . . . . 0.0 113.224 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -57.83 -52.42 65.53 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.931 0.892 . . . . 0.0 112.255 173.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.57 -36.06 82.66 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 176.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 37.3 t -68.59 -27.83 37.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 126.321 1.848 . . . . 0.0 113.166 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.6 -29.29 37.0 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 175.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.6 pttt -105.89 0.43 25.89 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.187 1.795 . . . . 0.0 113.795 176.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 45.8 ttm -93.44 -80.55 0.38 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.127 1.771 . . . . 0.0 111.799 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.91 143.82 49.15 Favored Pre-proline 0 N--CA 1.48 1.041 0 C-N-CA 126.997 2.119 . . . . 0.0 112.655 -175.024 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -68.21 -49.83 0.88 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 123.666 2.91 . . . . 0.0 113.304 -178.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.43 -37.01 86.04 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.241 1.416 . . . . 0.0 113.04 176.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.4 -40.09 95.13 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 118.761 -0.638 . . . . 0.0 110.062 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 12.5 tppt? -55.76 -50.18 71.13 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.478 171.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 50.4 mmtt -54.96 -54.6 40.74 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.266 0.939 . . . . 0.0 110.727 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.38 -47.57 81.5 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -71.0 -38.93 72.67 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.107 0.963 . . . . 0.0 112.285 -177.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.25 -47.88 82.4 Favored 'General case' 0 N--CA 1.465 0.297 0 O-C-N 121.052 -1.03 . . . . 0.0 111.409 171.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -56.85 -43.7 81.41 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.757 0.708 . . . . 0.0 112.225 172.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 13.0 tp -62.44 -39.94 94.97 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.722 1.147 . . . . 0.0 113.018 172.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.5 t -70.67 -45.16 65.59 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.857 -1.152 . . . . 0.0 112.81 -177.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -41.93 79.71 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.6 0.76 . . . . 0.0 110.984 175.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.3 tt -70.85 -29.73 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 179.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.49 -34.83 71.34 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -79.42 -28.29 41.75 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.399 1.08 . . . . 0.0 113.479 172.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -130.88 89.49 2.76 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.973 1.709 . . . . 0.0 112.469 -173.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -73.84 -9.14 58.35 Favored 'General case' 0 CA--C 1.549 0.933 0 O-C-N 120.643 -1.286 . . . . 0.0 113.909 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 66.8 m -70.12 -7.04 38.33 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 126.491 1.916 . . . . 0.0 115.233 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.83 166.21 15.93 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.783 1.233 . . . . 0.0 112.58 176.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.34 -178.51 3.5 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.217 1.407 . . . . 0.0 112.796 175.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.98 51.51 0.94 Allowed Glycine 0 N--CA 1.475 1.278 0 C-N-CA 126.382 1.944 . . . . 0.0 114.69 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 2.4 tp -53.05 -32.61 18.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 125.515 1.526 . . . . 0.0 113.32 177.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -46.64 -38.1 9.2 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.484 1.113 . . . . 0.0 113.092 173.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -62.52 -59.15 5.35 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.552 0.741 . . . . 0.0 112.039 171.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.5 -36.13 83.19 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.976 0.91 . . . . 0.0 112.815 -175.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -53.68 -54.65 34.9 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 126.636 1.974 . . . . 0.0 110.866 166.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.0 tttt -52.63 -52.09 57.08 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 117.686 -1.15 . . . . 0.0 110.597 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.9 mm -52.27 -50.96 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 119.44 1.018 . . . . 0.0 111.471 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -64.84 -42.57 94.8 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.1 0.864 . . . . 0.0 112.549 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.52 -36.13 83.22 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.887 1.275 . . . . 0.0 113.044 179.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.7 pp -78.13 -42.56 27.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 119.165 0.893 . . . . 0.0 111.856 170.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -55.57 -42.34 74.6 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.84 1.256 . . . . 0.0 113.187 179.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.63 -21.05 66.62 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.683 -1.261 . . . . 0.0 112.988 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 11.1 t -109.44 22.17 16.12 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.966 1.707 . . . . 0.0 113.201 -177.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 31.8 mt -112.45 156.22 42.55 Favored Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 125.589 1.555 . . . . 0.0 112.886 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -71.73 160.93 46.71 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.856 3.037 . . . . 0.0 112.899 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -63.39 -20.49 65.59 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 175.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.2 p -65.42 -51.55 59.52 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.933 1.242 . . . . 0.0 112.21 176.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.2 p -72.56 -39.08 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.649 -0.657 . . . . 0.0 111.424 176.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 29.1 mtmt -57.87 -50.15 74.3 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.034 0.834 . . . . 0.0 111.8 173.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -65.88 -40.76 91.9 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.552 1.069 . . . . 0.0 113.551 177.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.22 -35.35 79.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.575 1.08 . . . . 0.0 112.873 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.46 -23.33 26.03 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.356 1.063 . . . . 0.0 113.418 178.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -54.65 -20.81 8.9 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 126.609 1.964 . . . . 0.0 113.834 177.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.84 -18.94 58.76 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.32 1.448 . . . . 0.0 113.694 170.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -105.26 110.37 3.46 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 127.737 2.589 . . . . 0.0 111.657 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -117.16 63.4 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 126.289 1.836 . . . . 0.0 111.134 -174.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 52.44 74.86 0.26 Allowed Glycine 0 CA--C 1.538 1.521 0 C-N-CA 125.464 1.507 . . . . 0.0 112.698 -173.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -68.3 130.58 21.5 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.771 2.314 . . . . 0.0 111.428 -176.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 57.29 100.78 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 127.975 2.51 . . . . 0.0 114.512 -175.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 10.0 t -119.2 74.59 14.75 Favored Pre-proline 0 N--CA 1.483 1.203 0 C-N-CA 124.936 1.294 . . . . 0.0 111.222 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -75.81 -5.63 16.62 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 124.335 3.357 . . . . 0.0 114.74 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 128.421 2.688 . . . . 0.0 113.206 179.51 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 24.9 t70 . . . . . 0 CA--C 1.55 0.968 0 CA-C-O 121.752 0.786 . . . . 0.0 112.438 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -114.68 -172.02 2.04 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.273 1.829 . . . . 0.0 112.304 -176.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.7 155.16 4.15 Favored Pre-proline 0 N--CA 1.477 0.881 0 C-N-CA 124.544 1.138 . . . . 0.0 112.772 171.471 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -67.27 165.83 25.45 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 122.945 2.43 . . . . 0.0 111.539 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -64.66 117.79 4.83 Favored 'Trans proline' 0 CA--C 1.547 1.158 0 C-N-CA 122.529 2.153 . . . . 0.0 111.726 176.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.04 -21.43 27.61 Favored 'Trans proline' 0 CA--C 1.555 1.569 0 C-N-CA 122.523 2.149 . . . . 0.0 116.55 166.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.36 170.25 17.73 Favored 'Trans proline' 0 C--N 1.363 1.308 0 CA-C-N 124.18 2.529 . . . . 0.0 112.762 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -62.47 123.64 12.78 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.578 2.186 . . . . 0.0 110.846 173.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -52.87 -38.2 61.32 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 122.163 0.982 . . . . 0.0 111.868 169.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.82 22.42 1.13 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 128.709 2.804 . . . . 0.0 115.064 175.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -41.0 113.22 0.37 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.657 1.583 . . . . 0.0 113.44 175.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.94 23.28 0.19 Allowed Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.207 1.384 . . . . 0.0 114.742 -175.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -125.2 158.85 62.18 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 125.789 1.636 . . . . 0.0 112.347 -172.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.37 170.72 19.69 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.211 2.607 . . . . 0.0 113.106 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -52.45 -38.27 58.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.81 1.244 . . . . 0.0 113.277 -177.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -56.22 -40.2 73.7 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.623 1.569 . . . . 0.0 112.349 176.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 79.7 t -79.46 -39.55 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.963 1.305 . . . . 0.0 111.809 174.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 57.8 t -55.65 -38.94 52.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.0 0.92 . . . . 0.0 111.037 177.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -60.43 -50.63 72.81 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.799 -1.188 . . . . 0.0 112.221 174.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.67 -47.62 79.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.361 1.064 . . . . 0.0 111.616 177.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.63 -51.7 46.45 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.167 0.987 . . . . 0.0 111.671 168.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.54 -47.15 86.88 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 120.183 1.356 . . . . 0.0 113.287 -176.355 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -65.45 -34.18 77.68 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 122.545 0.338 . . . . 0.0 111.692 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.95 -54.63 14.32 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 173.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.26 -34.17 68.36 Favored 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 123.871 0.868 . . . . 0.0 112.517 -178.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -51.5 -30.54 20.51 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 171.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.8 tttt -74.91 -36.08 62.22 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.778 1.231 . . . . 0.0 113.145 173.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -102.64 15.08 30.32 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.499 1.52 . . . . 0.0 113.052 -177.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -63.36 -19.74 64.91 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.477 -1.39 . . . . 0.0 113.385 -172.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -100.4 1.04 40.99 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 126.947 2.099 . . . . 0.0 113.773 -178.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -79.38 177.73 8.63 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.786 1.635 . . . . 0.0 111.819 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.93 172.1 8.36 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.864 2.066 . . . . 0.0 111.938 177.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -49.56 -59.24 7.05 Favored Pre-proline 0 CA--C 1.546 0.793 0 C-N-CA 124.721 1.208 . . . . 0.0 113.107 175.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.21 -36.93 15.3 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.868 1.712 . . . . 0.0 112.607 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.74 -49.41 77.6 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.896 -1.127 . . . . 0.0 112.182 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.0 mt -61.94 -53.42 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-O 117.928 -1.034 . . . . 0.0 109.289 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -51.83 -44.87 63.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.301 1.41 . . . . 0.0 111.677 -176.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -51.13 68.34 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 125.108 1.363 . . . . 0.0 112.994 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.62 -39.14 92.87 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.106 0.562 . . . . 0.0 112.479 176.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -61.68 -50.18 73.52 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.518 1.127 . . . . 0.0 109.848 173.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -62.74 -28.38 69.93 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.34 -54.8 39.09 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.465 -0.772 . . . . 0.0 112.667 174.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 8.3 p-90 -73.84 -30.42 62.66 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 175.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.35 -29.67 46.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 120.623 -1.298 . . . . 0.0 112.667 175.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -58.95 -15.55 13.48 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.012 0.824 . . . . 0.0 113.147 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.9 p -115.07 -2.99 12.64 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.363 1.465 . . . . 0.0 113.56 177.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 9.7 mt -62.05 -53.44 55.45 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 175.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -166.59 -146.81 4.99 Favored Glycine 0 C--N 1.336 0.56 0 C-N-CA 123.957 0.789 . . . . 0.0 112.41 -166.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -98.03 -65.68 0.88 Allowed Glycine 0 C--O 1.223 -0.588 0 C-N-CA 124.683 1.135 . . . . 0.0 112.992 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -59.43 -31.68 69.5 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.622 1.169 . . . . 0.0 112.848 -168.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -55.39 -23.44 24.65 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 126.666 1.986 . . . . 0.0 113.649 174.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.2 ptmt -52.95 -33.89 53.08 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 171.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.79 -35.73 79.17 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.479 1.112 . . . . 0.0 111.574 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -43.33 92.22 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 117.961 -1.018 . . . . 0.0 110.831 168.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -64.33 -48.3 76.12 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 120.041 1.291 . . . . 0.0 112.512 177.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -58.64 -40.73 84.23 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.671 -0.643 . . . . 0.0 111.545 179.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.21 -34.54 59.25 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.99 -51.0 67.59 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.674 1.19 . . . . 0.0 110.737 170.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.5 ttpp -54.38 -45.27 72.8 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 117.987 0.358 . . . . 0.0 111.042 -175.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -61.7 -55.92 25.18 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.988 1.715 . . . . 0.0 113.016 172.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -57.22 -48.61 78.35 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.445 1.021 . . . . 0.0 112.575 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.0 ttt -64.01 -51.28 64.95 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.631 0.772 . . . . 0.0 112.424 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -52.93 -40.04 63.31 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 122.972 0.509 . . . . 0.0 111.86 172.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.14 -48.84 64.27 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.336 0.655 . . . . 0.0 111.244 -178.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -60.13 -53.08 62.03 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.046 0.938 . . . . 0.0 110.389 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -60.12 -50.46 73.6 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.569 1.147 . . . . 0.0 112.437 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.68 -47.33 86.08 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.261 0.937 . . . . 0.0 112.176 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.31 -45.12 85.64 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.252 -0.905 . . . . 0.0 112.823 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.4 mp -56.18 -47.64 77.9 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.735 0.814 . . . . 0.0 110.535 171.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.49 -47.18 84.93 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 117.678 -1.153 . . . . 0.0 111.933 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -56.18 -50.31 71.56 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 121.609 2.004 . . . . 0.0 113.376 175.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.07 -50.35 70.94 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.796 -0.565 . . . . 0.0 112.239 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 34.2 m170 -55.97 -41.13 74.28 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-O 117.694 -1.146 . . . . 0.0 111.354 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -51.03 71.71 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 126.182 1.793 . . . . 0.0 112.398 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -58.99 -47.16 86.15 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.3 176.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.1 -51.04 63.71 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 176.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 41.5 t -59.42 -28.56 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 126.976 2.11 . . . . 0.0 112.586 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.93 -28.57 24.12 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 173.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -101.73 -0.51 34.31 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.028 1.331 . . . . 0.0 114.354 176.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.1 mmt -88.23 -85.73 0.18 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.594 1.158 . . . . 0.0 110.775 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -129.7 155.22 80.71 Favored Pre-proline 0 N--CA 1.476 0.853 0 C-N-CA 127.039 2.135 . . . . 0.0 112.945 -176.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.5 -51.79 0.31 Allowed 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.76 2.973 . . . . 0.0 112.846 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -62.85 -34.18 76.82 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.463 1.505 . . . . 0.0 113.217 177.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -42.61 99.75 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 118.938 -0.553 . . . . 0.0 110.437 178.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.53 -45.85 77.11 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 117.909 -1.043 . . . . 0.0 110.951 171.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.4 mttt -58.08 -54.76 43.35 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.122 1.328 . . . . 0.0 111.839 177.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.62 -54.98 40.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.452 0.701 . . . . 0.0 112.498 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.68 -46.88 77.53 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.331 1.052 . . . . 0.0 112.758 175.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.84 -43.33 99.06 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.55 1.068 . . . . 0.0 111.502 -179.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.18 -46.91 82.42 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.082 0.953 . . . . 0.0 111.881 170.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.9 mp -63.53 -32.51 73.99 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 173.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.3 t -73.25 -41.45 63.67 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.783 1.233 . . . . 0.0 112.571 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -71.36 -44.36 65.17 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.485 -0.759 . . . . 0.0 111.023 176.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 15.8 tt -69.53 -30.07 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.06 -41.78 68.53 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.134 0.879 . . . . 0.0 112.388 176.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -76.03 -27.94 57.51 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.858 1.263 . . . . 0.0 113.518 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -131.52 78.05 1.81 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.835 1.254 . . . . 0.0 111.583 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -69.67 -22.66 63.42 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.622 -1.299 . . . . 0.0 112.916 -177.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 19.4 m -62.44 -15.65 50.69 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.422 1.489 . . . . 0.0 114.339 170.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -109.03 84.06 1.86 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.823 1.249 . . . . 0.0 109.466 176.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -95.01 -174.92 3.38 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.523 1.529 . . . . 0.0 111.546 173.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 109.0 -36.98 4.03 Favored Glycine 0 N--CA 1.47 0.949 0 C-N-CA 125.238 1.399 . . . . 0.0 113.282 177.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -60.93 -27.42 41.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 CA-C-N 118.167 0.984 . . . . 0.0 111.836 174.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.44 -37.68 39.39 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.417 1.087 . . . . 0.0 112.94 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.5 mtmt -60.32 -59.41 5.45 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.599 0.76 . . . . 0.0 111.135 173.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -62.88 -36.17 82.43 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.72 0.808 . . . . 0.0 112.916 -179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.7 -53.23 57.58 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.42 1.088 . . . . 0.0 110.802 170.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 50.6 tttt -55.04 -50.69 68.44 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.654 0.782 . . . . 0.0 111.66 175.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 23.5 mm -51.6 -48.75 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.688 1.195 . . . . 0.0 111.059 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -64.87 -42.58 94.73 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 120.17 1.35 . . . . 0.0 113.025 177.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.94 -40.96 99.22 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.856 0.863 . . . . 0.0 112.979 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -75.88 -35.39 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 121.378 -0.827 . . . . 0.0 111.782 172.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -58.98 -43.44 91.43 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.619 1.168 . . . . 0.0 112.889 179.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.05 -23.13 67.1 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.381 -0.824 . . . . 0.0 112.331 177.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.6 m -99.19 10.51 41.29 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.745 2.018 . . . . 0.0 112.522 -176.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 39.9 mt -65.15 157.12 78.51 Favored Pre-proline 0 CA--C 1.546 0.815 0 O-C-N 120.431 -1.418 . . . . 0.0 113.126 177.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -68.46 166.45 25.6 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 123.171 2.581 . . . . 0.0 112.586 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -26.28 53.92 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 174.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.2 t -59.4 -51.65 68.98 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.629 1.104 . . . . 0.0 111.924 179.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.8 -49.19 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.706 -0.621 . . . . 0.0 109.759 173.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -58.42 -37.52 75.54 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.59 -171.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -67.85 -46.28 72.2 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.78 1.632 . . . . 0.0 113.675 170.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -59.43 -34.08 72.04 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.85 1.204 . . . . 0.0 112.959 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.4 pp -91.87 -20.86 21.0 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.784 1.234 . . . . 0.0 113.651 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.33 -38.74 71.75 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.745 1.157 . . . . 0.0 112.412 171.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.02 -15.89 35.15 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.682 1.193 . . . . 0.0 113.831 174.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -94.58 106.07 3.36 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 126.067 1.794 . . . . 0.0 113.635 -174.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -140.26 56.82 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 126.094 1.758 . . . . 0.0 112.616 -169.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 49.54 74.97 0.22 Allowed Glycine 0 CA--C 1.539 1.591 0 C-N-CA 125.44 1.495 . . . . 0.0 112.737 -174.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -70.11 172.26 13.3 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.57 2.847 . . . . 0.0 111.914 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 57.92 97.13 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.379 1.871 . . . . 0.0 112.762 -170.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 7.5 p -106.28 80.4 0.68 Allowed Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.928 1.691 . . . . 0.0 111.647 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.68 -1.95 11.8 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.716 2.944 . . . . 0.0 114.278 177.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--O 1.255 1.342 0 C-N-CA 126.782 2.033 . . . . 0.0 112.461 -176.387 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 . . . . . 0 CA--C 1.546 0.812 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -148.83 -74.92 0.17 Allowed 'General case' 0 N--CA 1.475 0.792 0 O-C-N 121.012 -1.055 . . . . 0.0 112.609 176.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -80.56 162.86 59.19 Favored Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 126.581 1.952 . . . . 0.0 113.465 179.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -69.98 166.65 27.16 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.272 2.648 . . . . 0.0 112.377 175.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -64.47 116.84 4.0 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 123.762 2.975 . . . . 0.0 111.688 176.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -71.81 -22.09 24.06 Favored 'Trans proline' 0 CA--C 1.553 1.455 0 C-N-CA 122.102 1.868 . . . . 0.0 116.469 167.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.88 166.45 27.7 Favored 'Trans proline' 0 C--N 1.363 1.326 0 CA-C-N 124.332 2.583 . . . . 0.0 112.276 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.417 ' HA ' ' CZ ' ' A' ' 21' ' ' PHE . 40.2 Cg_endo -58.82 129.39 31.95 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.706 2.27 . . . . 0.0 110.843 171.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -48.68 -48.59 39.89 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 122.826 0.45 . . . . 0.0 111.296 172.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -83.33 29.29 0.5 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.508 1.923 . . . . 0.0 114.419 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -37.6 104.19 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.035 1.734 . . . . 0.0 114.919 -179.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 147.55 11.0 0.18 Allowed Glycine 0 CA--C 1.542 1.741 0 C-N-CA 125.626 1.584 . . . . 0.0 115.683 -173.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -109.54 159.26 32.18 Favored Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 125.745 1.618 . . . . 0.0 112.612 -172.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -73.98 169.55 22.14 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 123.019 2.479 . . . . 0.0 113.32 179.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -54.62 -38.09 66.39 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.656 1.183 . . . . 0.0 113.267 -177.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -53.39 -39.98 64.69 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.74 1.616 . . . . 0.0 112.486 174.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.2 t -82.08 -38.96 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 124.863 1.265 . . . . 0.0 112.077 176.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.7 t -56.71 -38.77 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 119.02 0.827 . . . . 0.0 111.337 176.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -62.65 -50.38 71.44 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.366 -0.834 . . . . 0.0 112.549 174.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.39 -47.76 75.35 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.083 0.953 . . . . 0.0 111.704 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 8' ' ' PRO . 15.5 t80 -51.18 -52.96 39.27 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.265 1.026 . . . . 0.0 111.897 168.493 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -47.4 85.72 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.02 0.827 . . . . 0.0 113.124 -177.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -65.18 -37.84 88.62 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.229 0.612 . . . . 0.0 111.772 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.2 tp -59.27 -52.24 66.49 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.063 0.545 . . . . 0.0 110.884 169.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.62 -29.11 70.37 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -179.246 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.9 mttm -54.15 -35.56 62.37 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.349 1.431 . . . . 0.0 112.9 172.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.57 -32.8 60.52 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.29 1.036 . . . . 0.0 113.118 175.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -97.69 16.65 19.95 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.166 1.786 . . . . 0.0 113.367 179.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.6 -17.05 64.3 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 119.787 -1.82 . . . . 0.0 113.867 -170.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.7 p -100.82 1.58 40.26 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 128.051 2.54 . . . . 0.0 113.771 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -79.72 165.48 22.78 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.921 1.688 . . . . 0.0 112.592 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.89 171.02 9.89 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.962 1.705 . . . . 0.0 111.97 176.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -47.91 -59.76 5.3 Favored Pre-proline 0 N--CA 1.474 0.732 0 C-N-CA 126.343 1.857 . . . . 0.0 113.078 174.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -65.16 -30.61 55.26 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 122.118 1.879 . . . . 0.0 113.43 179.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.44 -44.95 63.89 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.639 1.175 . . . . 0.0 111.963 -178.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 80.0 mt -66.57 -53.04 39.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.702 0.801 . . . . 0.0 109.647 172.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.95 -36.49 72.61 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 118.774 0.715 . . . . 0.0 111.837 -174.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -61.41 -60.44 3.71 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 125.382 1.473 . . . . 0.0 113.687 175.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -35.62 75.74 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -63.79 -51.0 66.77 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.501 1.121 . . . . 0.0 112.194 172.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -57.48 -36.71 71.84 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.022 0.828 . . . . 0.0 113.141 175.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.32 -51.1 67.81 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -178.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 6.9 p-90 -73.92 -32.51 63.57 Favored 'General case' 0 CA--C 1.553 1.093 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 170.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.72 -31.16 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 O-C-N 120.584 -1.323 . . . . 0.0 112.017 173.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -55.95 -24.14 36.34 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.065 0.848 . . . . 0.0 112.384 177.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.59 -16.99 26.27 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.031 1.333 . . . . 0.0 113.28 177.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 62.8 mt -67.75 -66.83 0.51 Allowed 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 118.669 0.668 . . . . 0.0 112.485 174.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 78.77 95.19 0.28 Allowed Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.26 0.933 . . . . 0.0 112.659 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -174.32 -166.49 32.45 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 124.99 1.281 . . . . 0.0 112.232 -178.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -58.06 -12.52 3.47 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.29 1.436 . . . . 0.0 114.333 176.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -53.91 -23.5 13.02 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.944 2.098 . . . . 0.0 113.688 172.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt -52.61 -37.49 58.37 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.209 1.403 . . . . 0.0 113.675 169.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.24 81.04 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.083 0.953 . . . . 0.0 111.599 177.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -67.46 -43.44 81.06 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-O 118.689 -0.672 . . . . 0.0 111.334 172.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -57.28 -53.83 53.66 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 119.873 1.215 . . . . 0.0 112.497 172.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -58.85 -45.3 90.4 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.454 0.57 . . . . 0.0 112.041 -178.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -66.15 -42.22 89.34 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.171 0.588 . . . . 0.0 112.43 178.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -66.3 -53.51 35.72 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 118.742 0.701 . . . . 0.0 111.994 178.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.41 -40.37 68.2 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.328 0.651 . . . . 0.0 111.689 178.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.88 -54.88 39.68 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.354 1.061 . . . . 0.0 113.29 170.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -56.76 -50.93 70.79 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.345 0.975 . . . . 0.0 112.746 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 ppp? -60.41 -51.76 68.09 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 176.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -56.39 -35.93 68.3 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.181 0.592 . . . . 0.0 112.478 175.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.01 -51.49 46.53 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.52 0.728 . . . . 0.0 111.155 178.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.4 tttt -60.39 -49.68 76.6 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.52 0.728 . . . . 0.0 111.001 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -61.59 -51.25 69.3 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.272 1.429 . . . . 0.0 112.506 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.94 -44.18 91.36 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.634 1.106 . . . . 0.0 112.525 176.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.81 -51.14 69.48 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.832 0.853 . . . . 0.0 111.792 177.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.6 mt -54.62 -51.16 66.23 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.261 1.024 . . . . 0.0 111.104 174.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.12 -44.38 87.72 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.214 1.006 . . . . 0.0 112.66 178.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.1 tttm -58.33 -50.66 72.85 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.81 1.244 . . . . 0.0 112.0 176.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.62 -46.42 88.35 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.644 0.778 . . . . 0.0 112.221 178.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.99 -51.33 70.1 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.817 0.847 . . . . 0.0 110.831 176.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -54.52 -46.49 73.53 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.979 1.312 . . . . 0.0 112.815 174.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -55.65 -50.1 71.13 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.669 0.788 . . . . 0.0 112.525 175.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -68.32 -30.86 69.94 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 176.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 63.3 t -72.93 -24.83 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 126.376 1.87 . . . . 0.0 113.42 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.67 -30.3 65.33 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 178.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.2 pttt -86.82 1.08 53.55 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.331 1.453 . . . . 0.0 114.492 173.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.6 ttm -103.88 -159.02 0.7 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.839 2.056 . . . . 0.0 111.568 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.47 156.63 21.75 Favored Pre-proline 0 N--CA 1.479 1.019 0 C-N-CA 125.424 1.49 . . . . 0.0 113.97 177.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.43 -46.6 1.29 Allowed 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 123.843 3.029 . . . . 0.0 113.141 -176.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -61.66 -32.12 72.27 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.784 1.233 . . . . 0.0 112.924 176.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.23 -46.98 86.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 122.751 0.42 . . . . 0.0 110.445 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -55.24 -43.55 74.68 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 118.367 -0.825 . . . . 0.0 111.103 174.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? -58.47 -53.17 61.33 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.681 1.128 . . . . 0.0 112.142 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.52 -44.71 95.75 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -73.13 -39.75 65.47 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.38 -47.66 84.82 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.835 0.854 . . . . 0.0 110.532 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -51.3 -51.66 52.24 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.057 0.943 . . . . 0.0 110.941 170.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -37.37 86.07 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.543 0.611 . . . . 0.0 112.446 -179.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.7 t -73.27 -43.59 60.77 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.199 -0.938 . . . . 0.0 112.885 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -46.52 73.72 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.367 0.667 . . . . 0.0 110.525 175.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.7 tp -66.65 -33.53 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 118.852 0.751 . . . . 0.0 112.018 -179.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.92 -31.81 72.96 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 177.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -93.18 -28.25 16.4 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 176.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -139.62 84.05 1.96 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.619 1.568 . . . . 0.0 112.523 -166.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -64.57 -9.95 22.83 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -177.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t -105.11 -5.81 20.47 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.682 1.993 . . . . 0.0 114.136 -177.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.3 mp -96.0 84.35 3.82 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.969 1.308 . . . . 0.0 110.473 -179.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -90.58 -169.81 2.51 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.291 1.437 . . . . 0.0 111.834 174.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 97.63 4.82 57.97 Favored Glycine 0 N--CA 1.477 1.39 0 C-N-CA 124.954 1.264 . . . . 0.0 115.418 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -61.94 -25.95 38.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 118.816 1.308 . . . . 0.0 113.01 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -53.61 -35.07 60.49 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.553 -0.717 . . . . 0.0 112.499 -179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -56.91 -59.52 4.93 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.006 0.522 . . . . 0.0 111.254 171.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.38 -38.07 88.93 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.313 0.506 . . . . 0.0 112.066 -175.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.03 -51.4 57.7 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.951 1.3 . . . . 0.0 110.459 170.458 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -57.76 -48.52 79.41 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 118.348 -0.834 . . . . 0.0 112.108 175.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 35.2 mm -52.72 -52.03 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.686 1.194 . . . . 0.0 111.879 177.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 38.5 mm-40 -66.61 -38.67 87.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.145 1.338 . . . . 0.0 112.547 177.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.85 -37.24 81.42 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.574 0.75 . . . . 0.0 112.976 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -84.53 -30.05 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.3 1.04 . . . . 0.0 113.338 172.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -64.32 -40.11 95.24 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.447 1.099 . . . . 0.0 112.788 177.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.4 pttt -64.98 -23.54 67.25 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.482 -0.761 . . . . 0.0 112.203 176.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 39.9 p -101.32 25.55 8.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 126.876 2.071 . . . . 0.0 113.023 175.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.71 72.05 1.0 Allowed Pre-proline 0 CA--C 1.554 1.112 0 C-N-CA 125.637 1.575 . . . . 0.0 110.448 174.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.6 163.7 37.16 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 123.227 2.618 . . . . 0.0 112.157 176.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -58.76 -25.91 63.5 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 174.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.9 m -62.43 -51.63 66.78 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.865 1.211 . . . . 0.0 111.857 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 10.2 p -70.53 -39.91 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 121.931 -0.48 . . . . 0.0 111.406 175.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -59.19 -47.24 86.05 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.381 0.672 . . . . 0.0 111.243 178.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -68.78 -44.65 73.22 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.244 1.017 . . . . 0.0 112.642 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -63.94 -33.83 76.61 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.893 -1.13 . . . . 0.0 113.076 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.0 -24.06 23.64 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.958 0.903 . . . . 0.0 113.037 177.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -52.16 -27.84 15.89 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 126.189 1.795 . . . . 0.0 113.554 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt -54.32 -37.8 65.25 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.686 1.594 . . . . 0.0 113.865 171.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 43.23 73.22 0.25 Allowed Glycine 0 CA--C 1.54 1.603 0 C-N-CA 126.913 2.197 . . . . 0.0 115.755 175.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -114.0 61.7 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.833 1.653 . . . . 0.0 112.842 -170.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 52.57 74.9 0.25 Allowed Glycine 0 CA--C 1.541 1.692 0 C-N-CA 125.414 1.483 . . . . 0.0 113.121 -177.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -72.05 89.68 0.77 Allowed 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 124.366 3.377 . . . . 0.0 112.938 -171.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -164.24 129.62 2.86 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 128.014 2.526 . . . . 0.0 109.159 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 12.9 t -119.0 75.98 14.42 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 125.356 1.462 . . . . 0.0 109.822 171.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -74.25 177.44 8.28 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 123.755 2.97 . . . . 0.0 112.385 176.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 . . . . . 0 C--O 1.252 1.211 0 C-N-CA 125.985 1.714 . . . . 0.0 111.343 173.749 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 121.355 0.598 . . . . 0.0 112.548 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -124.89 7.04 8.03 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.809 1.644 . . . . 0.0 113.144 -177.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.8 p -101.08 160.82 25.58 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 125.851 1.66 . . . . 0.0 113.2 179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -67.11 165.75 25.41 Favored 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 123.796 2.997 . . . . 0.0 113.201 175.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.19 126.5 15.16 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.897 2.398 . . . . 0.0 110.989 175.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.53 -23.21 37.45 Favored 'Trans proline' 0 CA--C 1.553 1.458 0 C-N-CA 122.765 2.31 . . . . 0.0 116.768 168.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.14 167.19 24.35 Favored 'Trans proline' 0 C--N 1.361 1.227 0 CA-C-N 124.141 2.515 . . . . 0.0 113.125 175.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.435 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 40.1 Cg_endo -61.4 120.83 8.69 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.117 2.545 . . . . 0.0 111.477 172.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -51.25 -33.76 29.53 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.088 0.955 . . . . 0.0 111.669 171.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.3 34.09 2.68 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 127.04 2.136 . . . . 0.0 113.702 178.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.49 110.67 0.24 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.016 1.326 . . . . 0.0 113.37 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 145.52 11.03 0.26 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.504 1.526 . . . . 0.0 115.24 -173.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.45 158.19 40.63 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.964 1.706 . . . . 0.0 112.575 -171.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.83 170.19 20.62 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 123.228 2.619 . . . . 0.0 112.962 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -54.82 -37.92 66.73 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.494 1.117 . . . . 0.0 113.545 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.45 -39.75 64.7 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.321 1.448 . . . . 0.0 112.512 173.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.5 t -80.69 -41.79 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 124.554 1.142 . . . . 0.0 112.095 175.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.1 t -55.79 -38.97 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 118.922 0.783 . . . . 0.0 111.249 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -60.62 -50.68 72.56 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.181 -0.95 . . . . 0.0 112.266 173.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.35 -47.13 76.2 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.208 1.003 . . . . 0.0 111.529 177.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.435 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -51.79 -53.79 35.95 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.677 1.191 . . . . 0.0 111.995 169.542 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -59.07 -47.51 84.99 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.681 1.128 . . . . 0.0 113.517 -178.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -68.09 -30.23 69.35 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.421 0.689 . . . . 0.0 112.298 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.7 tp -69.06 -45.36 70.57 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 121.556 -0.715 . . . . 0.0 111.646 168.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.16 -45.31 95.17 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.255 1.422 . . . . 0.0 113.943 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -24.52 54.59 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 119.36 0.982 . . . . 0.0 113.547 177.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -75.61 -36.48 60.25 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.535 1.934 . . . . 0.0 112.632 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -109.79 20.47 18.02 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.484 1.914 . . . . 0.0 112.798 178.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.9 -24.53 66.06 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.028 -1.67 . . . . 0.0 112.922 -174.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.67 -1.23 30.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.069 2.148 . . . . 0.0 113.797 178.357 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -89.75 171.7 9.45 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.745 1.618 . . . . 0.0 112.13 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.56 170.33 11.98 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 126.267 1.827 . . . . 0.0 112.041 175.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -45.45 -62.34 1.8 Allowed Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.501 1.52 . . . . 0.0 112.969 172.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.35 -35.26 24.43 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.034 1.823 . . . . 0.0 114.022 -179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -60.57 -44.96 95.59 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.116 -0.99 . . . . 0.0 112.234 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 61.6 mt -70.95 -47.75 60.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 118.74 -0.648 . . . . 0.0 111.162 175.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -52.38 -38.75 59.67 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.023 0.829 . . . . 0.0 110.902 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -51.0 71.21 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.671 1.588 . . . . 0.0 112.394 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.64 -38.49 89.51 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.162 0.585 . . . . 0.0 111.901 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -62.91 -51.09 68.29 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.459 1.103 . . . . 0.0 110.988 173.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -59.75 -34.0 72.39 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.283 1.033 . . . . 0.0 113.621 176.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.3 -52.24 66.42 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.717 -0.614 . . . . 0.0 112.57 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 10.7 p-90 -73.74 -29.85 62.47 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 172.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.64 -32.18 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 O-C-N 120.789 -1.194 . . . . 0.0 112.65 174.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -58.1 -17.82 20.76 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 175.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.57 -11.89 18.9 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.801 1.24 . . . . 0.0 113.385 177.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 19.9 mt -66.61 -60.84 2.35 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 175.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.78 70.64 1.15 Allowed Glycine 0 CA--C 1.538 1.48 0 C-N-CA 124.39 0.995 . . . . 0.0 113.827 -177.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -159.15 55.27 0.35 Allowed Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.119 1.342 . . . . 0.0 113.514 -178.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 74.18 -6.25 1.89 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 128.731 2.812 . . . . 0.0 114.225 -177.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -63.31 -20.93 65.92 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.863 1.665 . . . . 0.0 114.582 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -54.89 -35.55 64.21 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.969 1.708 . . . . 0.0 113.515 173.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.1 -39.04 92.58 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.64 0.776 . . . . 0.0 111.731 174.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.68 -41.49 98.16 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 118.156 -0.925 . . . . 0.0 112.063 170.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -55.24 -53.15 59.74 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.918 1.235 . . . . 0.0 112.506 173.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -61.75 -44.88 96.04 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.979 -0.45 . . . . 0.0 112.194 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.95 -38.74 83.17 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.783 -0.573 . . . . 0.0 112.311 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -65.98 -53.8 34.31 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 123.09 0.556 . . . . 0.0 111.524 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 19.9 ttpt -54.05 -40.86 67.49 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 119.197 -0.43 . . . . 0.0 111.717 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 67.6 mttt -59.0 -57.13 14.44 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.868 1.267 . . . . 0.0 113.911 169.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -53.68 -47.03 70.83 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.114 0.966 . . . . 0.0 112.254 179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -61.93 -53.27 58.06 Favored 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 123.737 0.815 . . . . 0.0 112.258 176.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -55.13 -36.15 65.45 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.122 0.569 . . . . 0.0 111.894 176.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.81 -51.51 40.02 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.008 0.923 . . . . 0.0 111.509 179.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.7 mttm -59.27 -49.39 78.01 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.338 1.055 . . . . 0.0 111.591 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.35 -54.11 50.54 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.259 1.423 . . . . 0.0 112.096 177.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.3 -44.63 96.9 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.572 1.078 . . . . 0.0 112.841 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -67.66 -45.45 75.25 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.616 -0.678 . . . . 0.0 112.389 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.49 -51.14 67.97 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.002 0.921 . . . . 0.0 110.565 170.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.02 -43.91 91.66 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.293 0.637 . . . . 0.0 112.247 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -56.74 -50.73 71.36 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.795 1.18 . . . . 0.0 112.161 174.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.12 -47.55 82.31 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.14 0.576 . . . . 0.0 112.194 179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -56.79 -49.93 73.85 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.919 1.288 . . . . 0.0 110.744 174.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -52.67 -48.6 66.41 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.92 1.688 . . . . 0.0 111.51 177.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -56.93 -49.5 75.45 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.895 1.278 . . . . 0.0 112.654 176.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.79 -30.84 71.54 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.923 1.082 . . . . 0.0 113.923 172.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 96.4 t -72.99 -24.43 20.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.967 1.307 . . . . 0.0 112.675 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.89 -28.73 62.24 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 176.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -89.82 1.41 56.19 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.156 1.382 . . . . 0.0 114.573 173.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.4 ttm -105.35 -161.62 0.82 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.795 2.038 . . . . 0.0 111.643 -172.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.9 155.66 22.43 Favored Pre-proline 0 N--CA 1.479 1.01 0 C-N-CA 124.622 1.169 . . . . 0.0 113.536 177.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.46 -42.6 3.56 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 123.387 2.725 . . . . 0.0 112.42 -178.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -63.55 -34.71 78.39 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.308 -0.87 . . . . 0.0 112.645 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.4 -41.28 93.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.744 0.818 . . . . 0.0 110.198 175.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.34 -48.05 74.78 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.89 174.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -59.4 -52.45 65.57 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.205 1.002 . . . . 0.0 111.629 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.9 -48.69 80.68 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 177.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -70.56 -42.4 71.19 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.447 -0.783 . . . . 0.0 112.512 -176.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.92 -43.4 98.92 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.083 -1.011 . . . . 0.0 112.2 173.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -54.92 -50.09 69.66 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.481 1.112 . . . . 0.0 111.471 171.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.4 tp -59.7 -37.74 79.69 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 173.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.6 t -73.23 -40.27 64.81 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.59 -1.319 . . . . 0.0 112.923 -177.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.5 ptpm? -69.21 -43.41 74.16 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.847 -0.597 . . . . 0.0 110.779 175.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.4 tt -70.03 -33.18 54.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 119.141 0.882 . . . . 0.0 112.341 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.71 69.48 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.289 1.036 . . . . 0.0 113.426 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -111.89 -0.03 15.96 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.303 1.441 . . . . 0.0 113.442 179.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -164.79 78.06 0.33 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.05 1.74 . . . . 0.0 111.921 -175.094 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -64.0 -23.91 67.51 Favored 'General case' 0 CA--C 1.549 0.909 0 O-C-N 119.945 -1.722 . . . . 0.0 112.879 -179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 t -75.11 -7.87 54.98 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.878 1.671 . . . . 0.0 114.323 177.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -100.47 84.31 2.76 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.309 1.444 . . . . 0.0 110.376 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -90.06 171.15 9.75 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.078 1.351 . . . . 0.0 112.253 171.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 138.77 -75.53 0.37 Allowed Glycine 0 N--CA 1.474 1.176 0 C-N-CA 125.398 1.475 . . . . 0.0 112.609 175.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.68 -26.29 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 118.481 1.141 . . . . 0.0 112.026 176.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.52 -35.3 39.97 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.692 0.797 . . . . 0.0 112.979 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -59.42 -59.36 5.58 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-O 118.967 -0.539 . . . . 0.0 111.588 171.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.16 -36.32 83.68 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.039 0.836 . . . . 0.0 112.707 -175.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.8 tm0? -51.72 -54.59 26.67 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.139 1.376 . . . . 0.0 110.791 167.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -57.52 -50.68 72.28 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 117.97 -1.014 . . . . 0.0 112.497 176.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 30.8 mm -52.17 -48.67 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.757 1.223 . . . . 0.0 111.556 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -67.51 -44.22 78.95 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.416 -0.803 . . . . 0.0 112.744 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.8 -37.84 83.34 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.084 0.953 . . . . 0.0 112.819 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -79.34 -34.24 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.021 0.928 . . . . 0.0 112.472 170.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -61.5 -37.22 82.88 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.957 1.253 . . . . 0.0 113.342 177.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -15.62 63.4 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.971 -1.081 . . . . 0.0 112.733 175.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 3.9 t -131.28 39.01 3.58 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.924 2.089 . . . . 0.0 112.222 -176.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 16.0 mt -51.34 147.99 9.44 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 124.218 1.007 . . . . 0.0 112.48 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -65.19 156.43 63.01 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 122.706 2.271 . . . . 0.0 112.49 -172.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -59.24 -24.88 63.56 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 12.7 t -63.0 -51.74 65.69 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.338 0.972 . . . . 0.0 111.875 175.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.7 p -72.89 -39.28 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 O-C-N 121.857 -0.527 . . . . 0.0 111.353 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -57.38 -50.18 73.81 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.11 0.868 . . . . 0.0 111.734 173.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -66.03 -43.43 87.6 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.934 1.243 . . . . 0.0 112.126 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -63.46 -33.63 75.99 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 120.57 -1.331 . . . . 0.0 113.067 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.22 -22.69 22.63 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.208 1.003 . . . . 0.0 113.151 178.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -56.99 -14.8 3.93 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 126.865 2.066 . . . . 0.0 114.137 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -23.96 55.84 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.132 1.773 . . . . 0.0 113.741 166.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -166.73 105.91 0.25 Allowed Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.337 0.97 . . . . 0.0 114.123 -176.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -132.12 63.91 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 126.588 1.955 . . . . 0.0 112.318 -174.378 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 47.84 74.76 0.23 Allowed Glycine 0 CA--C 1.544 1.847 0 C-N-CA 125.825 1.678 . . . . 0.0 113.588 -175.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -69.99 124.33 10.88 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.858 3.039 . . . . 0.0 112.624 -172.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -159.81 71.98 0.5 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.392 1.477 . . . . 0.0 111.666 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 11.5 t -131.19 78.17 73.17 Favored Pre-proline 0 N--CA 1.481 1.08 0 C-N-CA 124.568 1.147 . . . . 0.0 110.53 176.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -76.06 -5.24 16.1 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.862 3.041 . . . . 0.0 114.509 177.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.215 0 C-N-CA 127.371 2.268 . . . . 0.0 112.752 176.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 . . . . . 0 N--CA 1.477 0.901 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -152.18 95.05 2.01 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.581 1.552 . . . . 0.0 111.448 -178.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.2 p -69.46 158.23 87.39 Favored Pre-proline 0 N--CA 1.478 0.944 0 O-C-N 121.012 -1.055 . . . . 0.0 112.668 172.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -68.86 166.86 24.92 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.354 2.702 . . . . 0.0 112.244 176.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -64.88 116.51 3.86 Favored 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 123.025 2.483 . . . . 0.0 111.478 176.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -70.44 -22.59 28.76 Favored 'Trans proline' 0 CA--C 1.554 1.478 0 C-N-CA 122.041 1.827 . . . . 0.0 116.279 166.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -70.19 167.75 24.09 Favored 'Trans proline' 0 C--N 1.363 1.3 0 CA-C-N 124.078 2.492 . . . . 0.0 112.913 179.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -61.37 126.77 20.07 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.934 2.423 . . . . 0.0 110.467 172.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -56.73 -43.43 80.65 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 122.062 -0.399 . . . . 0.0 110.644 173.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -72.59 16.09 0.16 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 126.778 2.031 . . . . 0.0 116.453 174.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.34 106.71 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.804 2.041 . . . . 0.0 114.724 -174.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.87 30.59 0.17 Allowed Glycine 0 CA--C 1.537 1.458 0 C-N-CA 124.885 1.231 . . . . 0.0 114.837 -172.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -124.72 157.5 65.71 Favored Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 125.487 1.515 . . . . 0.0 111.925 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -73.18 168.15 25.48 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.304 2.669 . . . . 0.0 112.858 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -52.9 -37.47 60.66 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.667 1.187 . . . . 0.0 113.224 -178.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -57.92 -37.97 75.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.13 1.372 . . . . 0.0 112.643 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 84.6 t -80.12 -40.37 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.116 1.366 . . . . 0.0 111.481 173.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 32.2 t -57.02 -37.31 54.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.493 0.717 . . . . 0.0 111.15 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.9 tppt? -59.26 -50.18 75.0 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 120.545 -1.347 . . . . 0.0 112.223 174.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.15 -46.92 87.12 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.434 0.693 . . . . 0.0 111.263 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -51.97 60.24 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.145 0.978 . . . . 0.0 112.154 170.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -59.56 -47.49 85.36 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.609 1.095 . . . . 0.0 112.789 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -63.92 -37.04 85.93 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.583 0.753 . . . . 0.0 111.932 177.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.7 tp -66.38 -43.92 84.59 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.406 0.682 . . . . 0.0 112.166 173.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.71 -49.1 69.72 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.927 1.291 . . . . 0.0 113.543 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.3 pttt -56.31 -30.75 62.94 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.234 0.925 . . . . 0.0 113.017 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -65.92 -40.65 91.62 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.739 2.016 . . . . 0.0 112.345 174.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -109.73 28.28 8.72 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.568 1.947 . . . . 0.0 112.671 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -66.62 -24.65 66.34 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 119.888 -1.757 . . . . 0.0 112.374 -175.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.7 p -80.22 4.24 18.19 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 127.729 2.411 . . . . 0.0 114.361 177.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -87.51 170.92 10.92 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.431 1.492 . . . . 0.0 112.167 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.82 172.17 8.51 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.851 2.061 . . . . 0.0 111.643 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -51.16 -58.65 9.75 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.063 1.345 . . . . 0.0 112.591 176.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -68.67 -32.04 24.79 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 121.436 1.424 . . . . 0.0 113.128 178.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -65.89 -46.76 77.18 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 121.03 -1.044 . . . . 0.0 112.547 178.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 90.3 mt -65.66 -53.43 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 123.216 0.606 . . . . 0.0 109.555 175.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.09 -36.68 77.93 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 118.122 0.419 . . . . 0.0 112.007 -173.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.4 tttm -57.06 -57.07 14.17 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 126.008 1.723 . . . . 0.0 112.695 171.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -60.82 -40.43 92.71 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 122.871 0.468 . . . . 0.0 111.835 -177.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -59.01 -51.11 71.47 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.12 0.968 . . . . 0.0 111.101 171.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -62.93 -31.76 72.91 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.29 -52.01 67.08 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.58 0.752 . . . . 0.0 112.372 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 10.6 p-90 -73.29 -30.97 63.77 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 172.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -31.76 46.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.072 1.349 . . . . 0.0 112.596 174.023 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -57.83 -21.41 42.23 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 118.717 0.689 . . . . 0.0 112.716 174.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.38 -16.99 22.97 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.35 1.06 . . . . 0.0 112.941 178.3 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 22.8 mt -62.22 -63.04 1.36 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 178.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.29 101.46 0.76 Allowed Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.162 0.887 . . . . 0.0 112.138 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 161.35 -154.6 25.62 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.959 1.266 . . . . 0.0 112.145 -177.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -55.31 -19.81 9.69 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.894 1.277 . . . . 0.0 113.434 177.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -53.47 -23.2 9.48 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.58 1.952 . . . . 0.0 114.48 172.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -34.56 67.95 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.338 1.055 . . . . 0.0 113.286 173.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.0 -36.6 83.73 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.203 1.001 . . . . 0.0 110.953 176.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -35.11 79.13 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 117.704 -1.141 . . . . 0.0 112.429 171.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -66.72 -54.06 26.96 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 120.148 1.34 . . . . 0.0 112.331 174.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -59.82 -43.07 94.74 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 122.145 -0.347 . . . . 0.0 111.556 -178.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.2 -38.39 75.32 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.202 1.001 . . . . 0.0 112.602 177.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -56.59 -53.43 57.74 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.958 1.303 . . . . 0.0 110.511 174.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.64 -50.17 44.22 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.517 0.727 . . . . 0.0 110.892 -179.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.6 mmtm -61.95 -55.41 29.79 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.668 1.587 . . . . 0.0 113.573 175.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -54.24 -49.98 68.25 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.639 1.176 . . . . 0.0 112.142 179.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.9 tmm? -64.31 -51.74 61.97 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 123.982 0.913 . . . . 0.0 112.537 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 23.5 mttm -54.49 -34.99 62.63 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.22 -51.55 30.0 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.943 0.792 . . . . 0.0 111.722 178.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.8 -50.06 75.38 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.093 0.957 . . . . 0.0 110.832 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.07 -51.08 70.69 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.151 1.38 . . . . 0.0 112.133 178.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.8 -50.39 72.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 120.166 1.348 . . . . 0.0 112.555 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.67 -50.73 71.31 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.705 0.802 . . . . 0.0 112.475 178.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.1 tp -55.07 -49.65 71.11 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.213 1.405 . . . . 0.0 111.258 175.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.78 -44.16 97.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.825 1.25 . . . . 0.0 111.592 178.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.0 tttp -57.52 -50.22 73.8 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.773 1.17 . . . . 0.0 111.983 175.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.31 -49.7 74.59 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.662 0.785 . . . . 0.0 112.751 176.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.4 m80 -54.76 -50.84 67.44 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.635 0.774 . . . . 0.0 111.572 173.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -53.7 -47.92 70.04 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.836 1.654 . . . . 0.0 112.887 176.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.17 -48.43 73.77 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.014 0.926 . . . . 0.0 112.122 174.113 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.04 77.78 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 50.3 t -69.6 -26.03 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 126.167 1.787 . . . . 0.0 112.365 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.22 -31.78 44.92 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 173.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.3 pttt -93.2 -1.19 56.49 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 176.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -90.85 -81.37 0.31 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.425 1.09 . . . . 0.0 110.711 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.64 153.71 80.79 Favored Pre-proline 0 N--CA 1.481 1.078 0 C-N-CA 126.96 2.104 . . . . 0.0 113.273 -173.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.59 -48.24 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.828 3.018 . . . . 0.0 113.191 -178.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -66.73 -34.41 77.77 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.284 1.034 . . . . 0.0 112.389 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.71 -34.62 78.62 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.568 0.747 . . . . 0.0 111.921 178.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.33 -53.31 52.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 118.996 0.816 . . . . 0.0 109.837 170.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.1 mttt -59.84 -47.39 85.91 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.358 0.663 . . . . 0.0 111.053 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.63 -54.46 46.22 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.431 1.092 . . . . 0.0 113.43 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.41 -35.73 79.86 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.2 -0.937 . . . . 0.0 112.488 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.45 -45.78 71.57 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 121.473 -0.767 . . . . 0.0 110.941 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -52.62 -51.96 57.63 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.193 0.997 . . . . 0.0 111.261 168.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 7.0 tp -58.65 -37.18 75.41 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 119.286 0.948 . . . . 0.0 112.042 177.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.7 t -70.18 -48.23 58.11 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.066 -1.021 . . . . 0.0 112.581 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 ptpt -69.5 -36.28 76.33 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.789 0.836 . . . . 0.0 111.671 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.2 tp -72.34 -32.04 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 118.629 0.649 . . . . 0.0 111.77 176.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.27 -21.54 65.29 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 -177.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.26 15.15 19.39 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.708 1.603 . . . . 0.0 113.236 176.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -57.51 119.85 7.25 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.215 1.406 . . . . 0.0 113.728 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -102.33 -47.35 4.52 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.372 -0.83 . . . . 0.0 112.296 176.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 t -123.56 -0.93 8.59 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.403 1.481 . . . . 0.0 113.983 177.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.3 mp -67.83 161.29 26.57 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.719 1.207 . . . . 0.0 112.037 177.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -96.34 179.15 5.13 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.351 1.06 . . . . 0.0 111.054 176.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.87 56.64 2.2 Favored Glycine 0 N--CA 1.471 1.032 0 C-N-CA 125.571 1.558 . . . . 0.0 113.934 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -52.63 -24.42 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 125.778 1.631 . . . . 0.0 112.884 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.91 -35.35 6.36 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.35 1.06 . . . . 0.0 112.738 174.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.8 pttt -57.35 -53.48 57.63 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.356 1.462 . . . . 0.0 112.494 171.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -69.03 -33.77 74.15 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 120.294 1.406 . . . . 0.0 111.895 -179.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -59.09 -54.7 44.07 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 173.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.0 pttm -59.38 -42.77 92.45 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.529 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.5 mm -55.72 -48.52 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.325 1.05 . . . . 0.0 111.256 175.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -62.3 -45.35 93.66 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.237 1.381 . . . . 0.0 112.609 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.22 -35.47 81.16 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.584 0.754 . . . . 0.0 112.525 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.3 pt -79.31 -36.29 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 118.737 0.699 . . . . 0.0 112.208 170.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -59.15 -41.04 87.38 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.278 1.431 . . . . 0.0 112.024 179.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.7 -14.49 63.05 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.193 -0.942 . . . . 0.0 113.306 176.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.6 t -132.56 26.57 4.4 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.087 1.755 . . . . 0.0 113.936 -175.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 13.0 mt -47.43 145.79 3.77 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 125.809 1.644 . . . . 0.0 112.465 -178.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -63.82 155.52 63.34 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.629 2.219 . . . . 0.0 111.688 -177.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -58.47 -25.54 62.39 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.608 -0.682 . . . . 0.0 112.801 175.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.7 m -61.56 -51.61 67.87 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.38 1.445 . . . . 0.0 112.197 177.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 9.4 p -75.3 -38.77 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.752 -0.593 . . . . 0.0 111.793 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -57.69 -48.33 79.83 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 118.911 0.778 . . . . 0.0 111.999 172.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.68 -39.55 73.47 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.511 1.05 . . . . 0.0 112.806 178.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -66.31 -34.81 78.83 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.675 1.125 . . . . 0.0 112.442 177.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.65 -21.55 25.22 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.108 0.963 . . . . 0.0 113.219 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -55.17 -22.09 15.94 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.657 1.583 . . . . 0.0 113.864 179.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 26.2 mttm -56.28 -34.48 66.48 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 126.659 1.983 . . . . 0.0 113.076 170.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -174.41 133.96 2.67 Favored Glycine 0 CA--C 1.537 1.43 0 C-N-CA 124.193 0.901 . . . . 0.0 114.424 -178.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -114.69 66.91 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 126.92 2.088 . . . . 0.0 111.358 -169.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 47.99 74.84 0.22 Allowed Glycine 0 CA--C 1.54 1.628 0 C-N-CA 126.168 1.842 . . . . 0.0 113.245 -173.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -67.81 136.55 39.0 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.074 2.516 . . . . 0.0 111.812 -175.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -145.05 100.54 3.5 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.157 1.383 . . . . 0.0 110.397 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 17.4 t -123.73 75.79 56.07 Favored Pre-proline 0 N--CA 1.476 0.84 0 C-N-CA 124.671 1.188 . . . . 0.0 109.728 177.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -73.93 -7.67 20.27 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.584 2.856 . . . . 0.0 114.213 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.288 0 C-N-CA 126.906 2.082 . . . . 0.0 111.898 -179.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 CA--C 1.54 0.562 0 CA-C-O 121.548 0.69 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -149.93 165.66 31.94 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.128 1.771 . . . . 0.0 110.605 169.333 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.1 p -64.43 158.99 63.06 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 123.674 0.79 . . . . 0.0 112.261 171.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -68.36 164.11 33.84 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.888 2.392 . . . . 0.0 111.833 177.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -64.04 116.72 3.88 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 123.313 2.675 . . . . 0.0 111.731 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.25 -21.98 26.13 Favored 'Trans proline' 0 CA--C 1.554 1.478 0 C-N-CA 122.171 1.914 . . . . 0.0 116.5 167.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -70.28 166.53 27.92 Favored 'Trans proline' 0 C--N 1.362 1.268 0 CA-C-N 124.25 2.554 . . . . 0.0 112.873 178.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.31 126.86 19.49 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.814 2.343 . . . . 0.0 110.418 173.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -60.31 -33.81 72.9 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 119.807 -0.757 . . . . 0.0 111.419 174.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -77.91 17.26 0.6 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.33 2.252 . . . . 0.0 115.902 172.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -38.49 105.37 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.029 1.731 . . . . 0.0 114.922 -173.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 147.69 24.17 0.08 OUTLIER Glycine 0 CA--C 1.539 1.581 0 C-N-CA 124.864 1.221 . . . . 0.0 115.296 -172.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.96 158.97 46.53 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 125.098 1.359 . . . . 0.0 112.542 -173.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -73.46 167.29 27.67 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.196 2.598 . . . . 0.0 112.755 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -50.99 -40.7 58.57 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.503 1.521 . . . . 0.0 113.264 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -56.93 -37.48 71.55 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.48 1.512 . . . . 0.0 113.058 176.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.0 t -81.77 -41.11 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 125.0 1.32 . . . . 0.0 111.634 174.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 39.6 t -57.5 -36.94 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 123.956 0.902 . . . . 0.0 111.34 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.5 tptt -64.03 -43.22 96.26 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 172.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.77 -45.42 94.4 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.347 0.659 . . . . 0.0 110.54 175.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.76 -46.29 84.75 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-O 117.475 -1.25 . . . . 0.0 113.646 171.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.56 -47.02 83.26 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 120.192 1.36 . . . . 0.0 112.739 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.34 -38.25 88.78 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.02 0.928 . . . . 0.0 111.621 177.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.0 tp -63.89 -46.97 82.5 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 122.898 0.479 . . . . 0.0 111.46 171.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.44 -45.76 92.5 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.117 1.367 . . . . 0.0 114.443 -178.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -58.41 -28.26 65.05 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.664 1.12 . . . . 0.0 113.608 175.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -76.28 -32.61 58.9 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.503 1.521 . . . . 0.0 113.59 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -108.08 19.6 19.77 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.368 1.467 . . . . 0.0 114.197 176.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -57.79 -28.79 64.32 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 119.948 -1.72 . . . . 0.0 113.247 -177.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.7 m -77.18 -2.27 33.62 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.379 1.872 . . . . 0.0 113.767 179.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -83.21 167.28 17.85 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.381 1.472 . . . . 0.0 112.613 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.0 172.78 9.31 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 126.556 1.942 . . . . 0.0 112.213 177.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -50.77 -59.89 6.55 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 126.159 1.784 . . . . 0.0 112.913 175.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.8 -32.65 29.17 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.636 1.558 . . . . 0.0 112.974 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.65 -49.98 71.09 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.05 -1.032 . . . . 0.0 112.517 177.183 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 94.1 mt -61.93 -53.53 46.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 123.215 0.606 . . . . 0.0 110.228 174.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -58.52 -40.36 82.7 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 118.319 0.509 . . . . 0.0 112.342 -174.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.31 -54.22 49.22 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.412 1.885 . . . . 0.0 112.479 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.96 -41.12 97.63 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -59.36 -51.07 71.48 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 124.007 0.923 . . . . 0.0 113.033 171.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.61 -36.06 79.65 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 176.264 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.52 -50.33 73.42 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.159 0.89 . . . . 0.0 112.231 -177.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . 0.268 8.5 p-90 -69.24 -36.99 77.74 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 170.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.2 -31.19 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 125.109 1.364 . . . . 0.0 113.62 176.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -57.24 -17.66 12.6 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 175.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.35 -15.47 20.71 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.178 1.391 . . . . 0.0 113.689 176.058 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 32.6 mt -66.68 -61.23 2.08 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 118.899 0.772 . . . . 0.0 112.869 175.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.49 104.08 1.1 Allowed Glycine 0 CA--C 1.532 1.154 0 C-N-CA 124.007 0.813 . . . . 0.0 112.188 -177.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 166.73 -166.91 39.33 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.508 1.528 . . . . 0.0 111.724 -177.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -56.29 -18.26 10.11 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.42 1.088 . . . . 0.0 113.758 178.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -52.7 -27.81 19.11 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.752 2.021 . . . . 0.0 113.681 174.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -55.07 -36.55 65.73 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.061 1.344 . . . . 0.0 113.299 173.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.51 -52.49 64.28 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.389 1.075 . . . . 0.0 110.523 174.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.84 -42.91 48.4 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 117.244 -1.36 . . . . 0.0 112.009 172.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -55.33 -52.82 62.26 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.657 1.117 . . . . 0.0 112.425 173.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -58.94 -41.12 86.63 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.776 -0.577 . . . . 0.0 112.487 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.67 -43.61 72.18 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.212 1.005 . . . . 0.0 113.373 175.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.36 -47.05 73.06 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.664 1.186 . . . . 0.0 110.663 174.131 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.1 ttpp -52.8 -51.37 61.06 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.639 0.654 . . . . 0.0 111.633 -178.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.65 -53.53 53.19 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.329 1.052 . . . . 0.0 113.604 173.196 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.92 -49.44 75.61 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.413 1.006 . . . . 0.0 112.142 -178.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -65.03 -51.57 60.82 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.608 1.163 . . . . 0.0 112.348 177.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 22.0 mtmt -54.97 -34.06 62.98 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.994 0.815 . . . . 0.0 112.668 172.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.39 -48.31 50.7 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 119.693 1.133 . . . . 0.0 111.767 178.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.45 -52.27 65.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.013 0.925 . . . . 0.0 110.66 177.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.01 -49.89 76.18 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.873 1.269 . . . . 0.0 112.259 178.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.1 -45.45 94.65 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.339 0.972 . . . . 0.0 112.014 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -63.43 -49.78 72.36 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 118.762 0.71 . . . . 0.0 111.674 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.8 mt -56.27 -50.02 72.55 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.045 1.338 . . . . 0.0 111.36 174.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -64.08 -41.68 97.22 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 118.569 -0.729 . . . . 0.0 112.249 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -59.2 -50.61 73.35 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.792 1.178 . . . . 0.0 111.719 176.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.79 -50.07 73.82 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.119 0.967 . . . . 0.0 113.091 175.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -57.05 -52.31 65.78 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 118.716 -0.659 . . . . 0.0 111.515 174.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.477 ' HG2' ' HZ1' ' A' ' 85' ' ' LYS . 5.9 tt0 -55.12 -44.16 74.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.537 1.535 . . . . 0.0 112.908 177.06 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.59 -52.32 64.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.246 1.019 . . . . 0.0 112.709 172.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.2 -33.34 75.17 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.534 0.606 . . . . 0.0 112.505 177.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 56.0 t -72.65 -25.46 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.242 1.817 . . . . 0.0 112.301 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.45 -33.02 58.78 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 175.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.4 pttt -90.25 -0.69 57.74 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.511 1.524 . . . . 0.0 114.289 173.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 tpp -95.26 -159.22 0.7 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.612 1.965 . . . . 0.0 111.89 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.38 156.84 20.09 Favored Pre-proline 0 N--CA 1.478 0.953 0 C-N-CA 126.313 1.845 . . . . 0.0 114.334 176.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -71.75 -43.04 1.42 Allowed 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.85 3.034 . . . . 0.0 113.537 -175.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -58.98 -36.59 75.13 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.668 1.187 . . . . 0.0 111.765 174.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.86 -42.47 90.38 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.488 0.715 . . . . 0.0 110.321 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.477 ' HZ1' ' HG2' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -53.91 -46.45 71.44 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.302 1.041 . . . . 0.0 111.799 173.84 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -62.97 -51.95 64.88 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.509 1.123 . . . . 0.0 112.083 178.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.07 -55.66 30.22 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.47 0.708 . . . . 0.0 112.02 176.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.75 -31.17 71.64 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.98 77.1 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.751 1.16 . . . . 0.0 111.275 171.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -42.59 94.63 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 174.428 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.97 -39.41 94.06 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 118.979 0.808 . . . . 0.0 113.121 174.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.0 t -71.6 -39.59 70.42 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 120.952 -1.092 . . . . 0.0 111.856 -177.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.04 -37.57 64.26 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 118.831 -0.604 . . . . 0.0 112.17 176.478 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.4 tt -72.99 -32.25 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 119.133 0.879 . . . . 0.0 112.972 177.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.78 -22.69 64.35 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -94.17 -9.58 35.93 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.142 1.377 . . . . 0.0 113.613 173.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -144.18 92.06 2.28 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.234 1.814 . . . . 0.0 113.302 -174.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -70.59 -8.16 49.49 Favored 'General case' 0 CA--C 1.55 0.98 0 O-C-N 120.588 -1.32 . . . . 0.0 114.545 173.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.6 t -72.73 -11.6 60.68 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.382 1.473 . . . . 0.0 114.269 178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 45.8 mt -72.8 165.8 24.15 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.634 1.573 . . . . 0.0 112.925 177.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -73.85 177.07 5.79 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.823 1.249 . . . . 0.0 112.582 174.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.03 44.26 0.54 Allowed Glycine 0 N--CA 1.474 1.214 0 C-N-CA 126.027 1.775 . . . . 0.0 114.593 173.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -59.75 -34.96 57.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 118.807 1.303 . . . . 0.0 110.901 -178.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -55.66 -37.62 68.5 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.775 1.23 . . . . 0.0 113.009 -174.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -61.25 -58.7 7.23 Favored 'General case' 0 C--N 1.346 0.45 0 C-N-CA 124.627 1.171 . . . . 0.0 112.428 170.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.96 77.62 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.057 1.343 . . . . 0.0 113.312 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -56.6 -52.19 65.8 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.091 1.356 . . . . 0.0 111.527 168.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.88 -48.04 64.26 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 118.791 -0.624 . . . . 0.0 111.675 173.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.1 mm -58.31 -52.22 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 118.849 0.749 . . . . 0.0 111.407 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -63.57 -36.98 85.58 Favored 'General case' 0 C--O 1.242 0.683 0 O-C-N 121.501 -0.749 . . . . 0.0 112.782 178.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.64 -41.54 83.69 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.312 -1.328 . . . . 0.0 113.016 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.4 pt -75.14 -33.31 28.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 O-C-N 121.464 -0.773 . . . . 0.0 110.95 177.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -63.89 -48.38 76.87 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.235 -0.915 . . . . 0.0 111.598 176.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 12.2 mmtp -61.77 -25.03 67.22 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.224 1.01 . . . . 0.0 112.414 174.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 25.3 m -70.11 -44.7 68.43 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 118.836 0.744 . . . . 0.0 112.071 176.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 27.0 mt -60.06 151.39 66.17 Favored Pre-proline 0 CA--C 1.549 0.904 0 C-N-CA 124.047 0.939 . . . . 0.0 112.736 -178.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -67.52 157.51 61.42 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.804 2.336 . . . . 0.0 112.608 -175.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -22.04 66.86 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.539 -0.726 . . . . 0.0 112.523 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 49.9 m -64.91 -48.62 73.51 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 173.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.1 p -74.88 -37.16 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 119.002 0.819 . . . . 0.0 110.485 177.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -57.6 -50.41 73.22 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.963 0.801 . . . . 0.0 111.991 171.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -63.23 -44.0 96.51 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.49 1.041 . . . . 0.0 112.996 178.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -66.59 -32.83 74.41 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.482 -0.761 . . . . 0.0 112.714 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.92 -22.79 21.81 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.192 0.997 . . . . 0.0 113.682 178.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -52.77 -40.93 63.61 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.719 1.608 . . . . 0.0 111.953 176.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.08 6.48 47.53 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.682 1.593 . . . . 0.0 114.672 174.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -100.73 82.1 0.49 Allowed Glycine 0 CA--C 1.533 1.179 0 C-N-CA 126.508 2.004 . . . . 0.0 112.753 -177.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -128.09 68.38 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 125.852 1.661 . . . . 0.0 110.961 -176.534 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 53.45 75.22 0.24 Allowed Glycine 0 CA--C 1.561 2.916 0 C-N-CA 126.124 1.821 . . . . 0.0 110.965 176.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.11 164.16 33.69 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 122.507 2.138 . . . . 0.0 112.133 -175.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -154.72 109.32 3.01 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.625 1.97 . . . . 0.0 111.081 -178.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 32.1 t -137.05 132.04 18.04 Favored Pre-proline 0 N--CA 1.48 1.056 0 C-N-CA 125.877 1.671 . . . . 0.0 110.211 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -72.27 174.93 10.69 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 123.974 3.116 . . . . 0.0 113.129 175.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.286 0 N-CA-C 113.809 1.041 . . . . 0.0 113.809 174.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 . . . . . 0 CA--C 1.538 0.518 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -64.26 166.45 8.0 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.781 0.833 . . . . 0.0 111.978 170.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -58.43 154.79 31.29 Favored Pre-proline 0 N--CA 1.473 0.708 0 C-N-CA 123.875 0.87 . . . . 0.0 112.695 173.32 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -67.7 168.69 17.75 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 123.363 2.709 . . . . 0.0 112.276 178.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -64.95 116.01 3.59 Favored 'Trans proline' 0 CA--C 1.545 1.035 0 C-N-CA 122.896 2.397 . . . . 0.0 111.678 175.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -70.39 -23.47 27.89 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 CA-C-O 115.292 -2.045 . . . . 0.0 115.927 164.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -72.3 167.72 26.14 Favored 'Trans proline' 0 C--N 1.362 1.282 0 CA-C-N 124.596 2.677 . . . . 0.0 113.017 179.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -63.35 127.2 19.42 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.991 2.461 . . . . 0.0 112.053 177.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -62.32 -14.78 43.03 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 172.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.96 36.01 4.61 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 129.029 2.932 . . . . 0.0 112.409 177.236 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.89 109.82 0.19 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.682 1.593 . . . . 0.0 113.123 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.23 -19.4 1.37 Allowed Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.749 1.643 . . . . 0.0 114.069 -176.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.9 160.9 81.37 Favored Pre-proline 0 CA--C 1.558 1.276 0 C-N-CA 125.646 1.578 . . . . 0.0 113.753 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -75.68 171.54 18.0 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.921 3.081 . . . . 0.0 113.669 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -53.38 -35.17 60.04 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.619 1.168 . . . . 0.0 113.944 -178.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -54.35 -42.1 69.87 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.51 1.524 . . . . 0.0 112.068 174.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -77.81 -43.0 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 125.355 1.462 . . . . 0.0 112.099 173.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 88.3 t -55.29 -36.82 41.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 118.806 0.73 . . . . 0.0 111.352 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.7 tptm -62.96 -50.49 70.58 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.987 -1.071 . . . . 0.0 112.24 172.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.03 -48.34 73.54 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.467 0.707 . . . . 0.0 111.798 177.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -53.58 -52.42 59.81 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.738 1.215 . . . . 0.0 112.149 171.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -60.04 -47.51 85.56 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.571 1.078 . . . . 0.0 113.076 -179.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -63.71 -36.34 83.55 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.676 0.79 . . . . 0.0 111.732 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.7 tp -66.25 -46.06 78.41 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.372 0.669 . . . . 0.0 111.829 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -63.49 -45.97 88.29 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.843 1.257 . . . . 0.0 114.024 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -33.53 70.92 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 120.048 1.295 . . . . 0.0 113.461 177.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -69.1 -33.41 73.46 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.396 1.878 . . . . 0.0 112.95 173.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -107.04 20.34 19.17 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.019 2.128 . . . . 0.0 112.895 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -64.4 -25.51 68.05 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 119.775 -1.828 . . . . 0.0 112.762 -174.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.3 -5.01 59.0 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 127.142 2.177 . . . . 0.0 113.335 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.2 mmtt -76.09 -177.71 4.07 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.332 1.453 . . . . 0.0 112.906 178.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.77 172.77 6.67 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 128.082 2.553 . . . . 0.0 111.705 -177.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -49.96 -59.83 6.23 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 125.28 1.432 . . . . 0.0 112.426 176.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.45 -32.91 18.89 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 121.613 1.542 . . . . 0.0 113.261 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.48 -48.06 81.25 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.063 -1.023 . . . . 0.0 111.955 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 54.2 mt -66.1 -52.27 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.278 0.631 . . . . 0.0 110.02 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -57.08 -41.12 78.26 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.69 0.677 . . . . 0.0 111.814 -177.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -52.35 65.98 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.294 1.438 . . . . 0.0 112.917 174.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -62.25 -42.47 99.35 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -60.1 -49.73 76.49 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.295 1.038 . . . . 0.0 110.979 173.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.8 -35.44 76.5 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 176.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.73 -49.36 76.81 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.447 -0.783 . . . . 0.0 112.339 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 9.9 p-90 -73.17 -32.94 65.15 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 172.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.39 -30.68 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 125.507 1.523 . . . . 0.0 112.987 174.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.84 -19.28 16.57 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 118.803 0.729 . . . . 0.0 112.907 174.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.27 -18.54 22.36 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.799 1.24 . . . . 0.0 113.795 175.178 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 33.0 mt -65.45 -61.98 1.79 Allowed 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 178.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.61 98.85 0.73 Allowed Glycine 0 CA--C 1.534 1.234 0 C-N-CA 123.937 0.779 . . . . 0.0 112.211 -177.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 173.66 -166.34 38.57 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 125.266 1.412 . . . . 0.0 111.876 -177.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -56.14 -17.97 8.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.688 1.195 . . . . 0.0 113.865 177.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -55.19 -23.28 21.12 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.79 2.036 . . . . 0.0 113.859 173.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.8 pttt -54.58 -37.49 65.58 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.269 1.427 . . . . 0.0 113.07 171.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.74 -52.49 63.02 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.738 0.815 . . . . 0.0 110.077 174.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.82 -45.15 29.51 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 118.126 -0.94 . . . . 0.0 111.998 172.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -56.2 -52.42 64.48 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.835 0.854 . . . . 0.0 112.426 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.08 -44.02 91.85 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.65 -0.656 . . . . 0.0 111.924 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.61 -40.08 92.23 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.975 0.91 . . . . 0.0 113.278 175.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.5 -53.23 59.93 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.216 1.006 . . . . 0.0 111.053 172.255 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.0 ttmm -52.61 -52.78 53.82 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.43 0.692 . . . . 0.0 110.734 -174.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 11.4 pttp -65.71 -43.68 88.38 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.359 1.064 . . . . 0.0 113.36 176.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.72 -50.47 73.34 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.808 1.185 . . . . 0.0 111.834 178.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.76 -51.5 66.9 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.653 1.181 . . . . 0.0 111.905 177.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.5 mtmm -57.86 -33.6 68.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.46 -50.15 34.44 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.037 0.835 . . . . 0.0 111.444 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 tttm -57.15 -49.73 75.02 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.654 0.782 . . . . 0.0 110.396 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -62.19 -52.0 65.53 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.72 1.208 . . . . 0.0 112.23 179.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.66 -46.27 90.47 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.803 1.183 . . . . 0.0 112.859 178.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -61.75 -50.16 73.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.527 1.131 . . . . 0.0 111.398 178.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tt -56.7 -51.16 69.86 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.467 1.107 . . . . 0.0 110.685 174.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.38 -40.86 97.85 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.982 -178.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.1 tttt -59.01 -50.86 72.5 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.384 0.993 . . . . 0.0 111.379 173.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.33 -44.87 86.43 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.268 0.556 . . . . 0.0 111.548 -176.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -60.53 -49.36 77.86 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.798 1.239 . . . . 0.0 110.94 175.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.03 -43.21 86.65 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.647 1.112 . . . . 0.0 112.843 175.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -55.14 -52.57 62.86 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.43 1.092 . . . . 0.0 112.445 173.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.51 -31.27 71.89 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 175.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.4 t -73.05 -23.76 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.678 1.591 . . . . 0.0 113.382 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.63 -30.77 67.54 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.695 1.369 . . . . 0.0 114.695 177.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -86.09 -2.65 58.52 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.516 1.526 . . . . 0.0 114.219 172.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.9 tpp -96.86 -160.41 0.8 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.407 1.883 . . . . 0.0 111.833 -174.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.89 156.64 18.14 Favored Pre-proline 0 N--CA 1.478 0.971 0 C-N-CA 126.735 2.014 . . . . 0.0 113.984 174.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.79 -48.32 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 123.599 2.866 . . . . 0.0 112.858 -176.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -57.13 -32.96 66.89 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.034 1.334 . . . . 0.0 112.269 177.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.22 -48.79 74.49 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.474 0.709 . . . . 0.0 110.596 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -54.87 -45.5 74.62 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.713 0.688 . . . . 0.0 111.235 173.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? -54.99 -54.91 36.86 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 118.867 0.758 . . . . 0.0 111.241 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.54 -51.93 67.74 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.956 0.903 . . . . 0.0 113.15 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.4 -40.5 95.93 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -178.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.19 -45.11 94.84 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.481 0.712 . . . . 0.0 110.93 174.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -43.88 90.67 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.399 0.545 . . . . 0.0 112.374 172.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.63 -36.96 84.5 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 174.439 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 10.3 t -70.67 -42.41 70.77 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.406 1.082 . . . . 0.0 112.987 -178.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -70.5 -44.01 68.51 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.521 -0.737 . . . . 0.0 111.133 175.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.8 tt -68.26 -30.63 48.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 118.697 0.681 . . . . 0.0 112.371 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.06 -33.69 69.31 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 176.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -92.21 -28.29 17.12 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.087 0.955 . . . . 0.0 113.412 173.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -138.36 78.79 1.7 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.873 1.269 . . . . 0.0 112.501 -175.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -71.13 -11.12 60.77 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 70.1 m -83.26 -2.82 56.57 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.94 1.696 . . . . 0.0 114.502 175.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 97.5 mt -112.21 84.19 1.93 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.432 1.493 . . . . 0.0 111.826 -178.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -95.23 169.76 9.86 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.989 1.315 . . . . 0.0 112.616 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 123.21 -47.28 1.03 Allowed Glycine 0 N--CA 1.474 1.18 0 C-N-CA 127.143 2.306 . . . . 0.0 112.944 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -60.66 -25.67 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 CA-C-N 117.889 0.844 . . . . 0.0 112.506 179.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -44.94 -38.45 4.69 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.761 1.224 . . . . 0.0 112.994 172.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -63.99 -59.38 4.56 Favored 'General case' 0 C--N 1.345 0.394 0 C-N-CA 123.571 0.748 . . . . 0.0 111.031 174.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -63.16 -33.32 75.22 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.994 0.816 . . . . 0.0 113.071 -178.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.74 -53.73 53.04 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.688 1.595 . . . . 0.0 110.805 168.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -58.12 -48.12 81.19 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.044 0.937 . . . . 0.0 112.527 175.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 26.9 mm -54.05 -52.05 40.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.666 0.786 . . . . 0.0 110.562 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -66.62 -40.97 89.01 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 118.688 -0.672 . . . . 0.0 112.392 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.82 -40.36 94.99 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.566 1.075 . . . . 0.0 111.122 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 53.3 mt -75.86 -51.76 19.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 C-N-CA 123.983 0.913 . . . . 0.0 110.978 176.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -54.46 -46.44 73.34 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 118.879 0.763 . . . . 0.0 112.726 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 15.8 mmtp -65.61 -22.53 66.68 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.811 1.244 . . . . 0.0 112.424 176.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 93.7 m -86.69 -38.11 17.32 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.082 1.353 . . . . 0.0 112.929 177.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 31.9 mt -54.95 153.61 11.26 Favored Pre-proline 0 CA--C 1.553 1.09 0 C-N-CA 124.901 1.28 . . . . 0.0 113.146 176.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.65 158.83 55.72 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.951 2.434 . . . . 0.0 113.01 -176.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.04 -24.49 67.73 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.242 -0.911 . . . . 0.0 112.784 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.5 m -60.94 -51.54 68.85 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.248 0.931 . . . . 0.0 112.145 173.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.57 -37.34 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-N 118.529 0.604 . . . . 0.0 111.573 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.2 mtmp? -58.01 -49.89 75.31 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.794 -0.622 . . . . 0.0 111.972 172.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -64.33 -45.08 89.42 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.091 0.86 . . . . 0.0 112.891 177.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -65.63 -32.03 73.38 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.692 0.678 . . . . 0.0 112.744 -179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.19 -21.57 21.07 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 178.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -53.86 -38.22 64.46 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.875 1.27 . . . . 0.0 112.521 179.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.4 ttpt -72.07 -21.7 61.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.128 1.371 . . . . 0.0 113.761 177.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 60.46 -166.79 11.0 Favored Glycine 0 CA--C 1.539 1.591 0 C-N-CA 124.949 1.261 . . . . 0.0 114.391 -174.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -130.91 63.27 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 126.598 1.959 . . . . 0.0 110.947 -173.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 50.53 74.8 0.25 Allowed Glycine 0 CA--C 1.54 1.62 0 C-N-CA 126.473 1.987 . . . . 0.0 113.464 -175.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.03 128.56 17.88 Favored 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.364 2.71 . . . . 0.0 111.755 -175.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 47.69 80.58 0.05 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.388 2.275 . . . . 0.0 114.197 -176.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 9.3 p -62.16 132.3 93.81 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.212 1.405 . . . . 0.0 111.278 178.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -74.35 174.69 12.09 Favored 'Trans proline' 0 CA--C 1.546 1.109 0 C-N-CA 122.676 2.251 . . . . 0.0 112.888 176.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 . . . . . 0 C--O 1.253 1.255 0 C-N-CA 125.967 1.707 . . . . 0.0 113.06 171.963 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 . . . . . 0 CA--C 1.539 0.528 0 CA-C-O 120.734 0.302 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -150.17 87.34 1.46 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 122.529 1.157 . . . . 0.0 110.246 177.003 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.11 158.15 80.25 Favored Pre-proline 0 CA--C 1.54 0.589 0 C-N-CA 123.827 0.851 . . . . 0.0 112.101 176.367 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -68.18 170.71 13.98 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 123.364 2.71 . . . . 0.0 112.482 177.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -64.82 115.65 3.37 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 122.686 2.257 . . . . 0.0 111.663 173.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -71.65 -19.78 27.51 Favored 'Trans proline' 0 CA--C 1.554 1.486 0 C-N-CA 122.099 1.866 . . . . 0.0 116.11 164.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.48 169.43 20.93 Favored 'Trans proline' 0 C--N 1.362 1.281 0 CA-C-N 124.272 2.561 . . . . 0.0 112.729 177.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -60.1 122.31 11.18 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.858 2.372 . . . . 0.0 110.75 171.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -53.4 -32.62 50.38 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.054 0.542 . . . . 0.0 111.949 172.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.12 38.9 1.66 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 128.312 2.645 . . . . 0.0 113.138 176.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.72 112.92 0.48 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.808 1.243 . . . . 0.0 113.296 176.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.5 11.06 0.32 Allowed Glycine 0 CA--C 1.538 1.474 0 C-N-CA 125.296 1.427 . . . . 0.0 115.634 -176.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -111.27 159.8 31.55 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 125.645 1.578 . . . . 0.0 112.846 -171.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -73.53 169.74 21.6 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.298 2.665 . . . . 0.0 113.085 178.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -52.53 -35.19 52.83 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.553 1.141 . . . . 0.0 113.659 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -56.38 -39.07 72.34 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.205 1.402 . . . . 0.0 112.802 174.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.5 t -77.91 -44.83 28.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.595 1.158 . . . . 0.0 111.792 171.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 94.2 t -54.22 -37.53 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 123.366 0.667 . . . . 0.0 111.468 -178.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.7 tppt? -59.91 -50.57 73.25 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.363 -0.836 . . . . 0.0 112.376 174.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.95 -47.97 83.17 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.044 0.938 . . . . 0.0 111.728 177.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -53.79 -53.67 49.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.665 0.786 . . . . 0.0 111.433 172.609 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -63.19 -45.1 93.31 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.445 1.02 . . . . 0.0 113.138 -179.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -59.74 -39.17 83.88 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.231 1.013 . . . . 0.0 111.555 177.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.9 tp -68.31 -45.8 71.99 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.148 0.579 . . . . 0.0 111.577 172.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -45.73 87.0 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -56.88 -31.62 65.03 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 119.649 1.113 . . . . 0.0 112.431 178.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -73.65 -29.34 62.27 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.025 1.33 . . . . 0.0 111.744 175.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -109.81 23.7 14.03 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.045 1.738 . . . . 0.0 112.549 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -22.09 66.57 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 119.904 -1.747 . . . . 0.0 113.687 -175.502 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.0 p -92.88 4.11 54.48 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 128.803 2.841 . . . . 0.0 114.307 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -85.75 179.9 6.97 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.329 1.452 . . . . 0.0 111.858 178.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.22 171.27 7.71 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.284 2.234 . . . . 0.0 111.562 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -52.13 -57.62 14.51 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 124.625 1.17 . . . . 0.0 112.338 176.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.9 -33.19 27.16 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.516 1.477 . . . . 0.0 113.319 178.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.23 -47.14 80.83 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.166 -0.959 . . . . 0.0 112.603 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.4 mt -68.44 -53.28 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.089 0.556 . . . . 0.0 109.651 175.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -56.93 -35.84 69.52 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 119.023 -0.513 . . . . 0.0 112.068 -175.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 34.7 tttt -56.97 -58.32 8.66 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.194 1.798 . . . . 0.0 113.434 172.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -59.06 -40.06 84.0 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 122.962 0.505 . . . . 0.0 111.084 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -60.26 -50.33 74.08 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.369 1.068 . . . . 0.0 111.253 173.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.56 -33.25 71.19 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.62 -51.86 68.14 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.603 -0.686 . . . . 0.0 112.213 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 13.4 p-90 -73.8 -30.77 62.92 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 172.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.11 -32.15 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 O-C-N 120.781 -1.2 . . . . 0.0 112.677 174.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -58.0 -19.24 29.46 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 118.565 0.62 . . . . 0.0 112.268 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.89 -14.89 21.49 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.878 1.271 . . . . 0.0 113.222 177.273 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 22.8 mt -62.27 -65.94 0.61 Allowed 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 118.99 0.814 . . . . 0.0 112.528 175.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.32 104.59 0.67 Allowed Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.015 0.817 . . . . 0.0 111.807 -177.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 163.28 -163.29 35.45 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 125.181 1.372 . . . . 0.0 111.495 -176.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -57.58 -18.24 18.54 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.99 1.316 . . . . 0.0 113.439 -178.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -55.55 -21.65 18.06 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.072 2.149 . . . . 0.0 113.973 171.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.0 ptmt -55.05 -35.07 64.11 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.575 1.55 . . . . 0.0 113.613 171.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.81 -40.67 92.1 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.833 0.853 . . . . 0.0 111.27 174.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.17 -42.32 94.71 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 117.612 -1.185 . . . . 0.0 111.887 170.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -58.43 -52.85 63.89 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 120.406 1.457 . . . . 0.0 112.9 174.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -60.75 -42.11 96.76 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.811 -0.556 . . . . 0.0 111.621 -178.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.19 -34.83 63.88 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.816 0.846 . . . . 0.0 112.584 -179.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -57.35 -52.76 64.07 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 125.298 1.439 . . . . 0.0 111.095 172.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.35 -44.55 65.27 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.269 0.356 . . . . 0.0 110.786 -176.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 24.1 mmtt -61.68 -57.16 13.07 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.106 1.762 . . . . 0.0 114.277 171.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -55.37 -50.24 70.22 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.422 1.089 . . . . 0.0 112.376 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -63.98 -51.9 62.15 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 124.183 0.993 . . . . 0.0 112.298 178.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -52.83 -39.12 62.2 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.329 173.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.08 -51.42 54.67 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.023 0.829 . . . . 0.0 111.885 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.4 mttm -58.87 -51.67 69.01 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.013 0.925 . . . . 0.0 111.272 175.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.22 -52.63 64.78 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.809 1.244 . . . . 0.0 111.963 177.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.83 -52.75 63.87 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.827 1.194 . . . . 0.0 112.863 178.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -62.85 -48.99 76.64 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.323 0.649 . . . . 0.0 112.314 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tp -54.84 -49.66 70.52 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.964 1.306 . . . . 0.0 111.171 174.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.22 -43.6 98.62 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.515 1.126 . . . . 0.0 111.729 178.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -58.25 -50.76 72.42 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.588 1.085 . . . . 0.0 111.954 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.96 -48.5 78.63 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.539 1.136 . . . . 0.0 112.633 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -57.3 -54.24 49.08 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.879 0.872 . . . . 0.0 110.979 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -40.99 72.87 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.998 1.319 . . . . 0.0 113.041 177.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.02 -52.63 64.71 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.479 0.712 . . . . 0.0 112.424 172.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.04 -31.49 72.05 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 176.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 62.8 t -73.04 -23.84 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 126.016 1.726 . . . . 0.0 112.63 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.78 -32.66 63.66 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.684 -1.26 . . . . 0.0 114.159 176.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -87.92 0.45 55.85 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.527 1.531 . . . . 0.0 114.551 174.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.3 mmt -94.57 -159.82 0.73 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.734 1.614 . . . . 0.0 111.254 -178.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.8 156.43 6.66 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.209 2.203 . . . . 0.0 114.038 173.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -69.38 -45.49 1.77 Allowed 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 123.692 2.928 . . . . 0.0 112.726 -176.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -59.67 -31.32 69.44 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.143 0.977 . . . . 0.0 112.223 176.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -66.03 -49.23 68.46 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.191 0.596 . . . . 0.0 110.283 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.02 -46.88 61.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.891 0.877 . . . . 0.0 110.714 172.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -58.93 -54.91 41.85 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.734 0.814 . . . . 0.0 111.162 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.69 -47.84 84.47 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.541 0.736 . . . . 0.0 112.75 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.85 -40.05 83.73 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.08 -45.74 92.19 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 119.455 1.025 . . . . 0.0 110.742 174.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.62 -44.05 89.86 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.117 0.967 . . . . 0.0 112.219 173.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.8 tp -63.96 -36.66 84.71 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 121.576 -0.703 . . . . 0.0 112.539 171.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.7 t -72.28 -39.35 68.39 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 120.357 -1.464 . . . . 0.0 112.899 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -71.16 -43.51 67.36 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.732 0.813 . . . . 0.0 110.989 175.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 7.3 tt -70.17 -32.13 49.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 118.588 0.631 . . . . 0.0 112.446 178.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.18 -30.21 64.32 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -92.46 0.78 57.47 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.256 1.422 . . . . 0.0 114.526 177.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -138.1 106.92 5.93 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.655 1.582 . . . . 0.0 113.411 -173.174 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -81.53 -22.74 37.7 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 178.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -84.42 -2.23 56.86 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.703 1.601 . . . . 0.0 114.284 176.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.0 mt -77.5 167.2 22.04 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 122.239 1.019 . . . . 0.0 113.37 172.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -80.02 165.29 22.71 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.708 1.603 . . . . 0.0 112.281 171.142 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -82.04 60.84 4.75 Favored Glycine 0 N--CA 1.468 0.797 0 C-N-CA 125.924 1.726 . . . . 0.0 113.034 178.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.36 -30.04 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.985 0.914 . . . . 0.0 112.172 179.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.07 -38.98 8.63 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.688 1.595 . . . . 0.0 113.101 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.78 -59.5 5.33 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.314 173.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -63.74 -33.69 76.22 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.735 0.698 . . . . 0.0 111.7 -176.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -60.14 -47.91 83.93 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.288 1.035 . . . . 0.0 111.817 173.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -46.35 91.08 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 118.403 -0.808 . . . . 0.0 111.665 174.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 24.9 mm -53.19 -49.81 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 125.123 1.369 . . . . 0.0 111.194 174.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -63.31 -44.17 95.71 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.98 1.264 . . . . 0.0 112.603 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.24 -49.03 79.23 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 122.707 0.403 . . . . 0.0 111.151 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.4 pp -70.99 -31.98 46.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 118.289 -0.863 . . . . 0.0 112.497 174.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -60.47 -42.78 96.91 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 120.345 1.43 . . . . 0.0 111.904 178.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -75.58 -11.72 60.07 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 174.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 33.2 p -130.72 48.9 2.37 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.382 1.473 . . . . 0.0 112.795 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.0 149.88 16.61 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 123.898 0.879 . . . . 0.0 111.407 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.35 150.74 84.39 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.308 2.005 . . . . 0.0 111.684 -177.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -62.79 -22.5 66.66 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 176.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.9 m -62.61 -51.64 66.52 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.911 1.232 . . . . 0.0 112.256 174.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 9.4 p -73.6 -38.81 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 O-C-N 121.755 -0.591 . . . . 0.0 111.163 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 29.6 mmtt -58.31 -49.29 77.69 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.53 -0.731 . . . . 0.0 111.922 174.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -66.68 -43.56 84.14 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.445 1.02 . . . . 0.0 113.024 177.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -64.98 -36.74 85.39 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.368 -0.832 . . . . 0.0 112.429 179.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.67 -22.03 26.34 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.288 1.035 . . . . 0.0 113.128 179.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -52.91 -34.07 53.45 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.703 1.601 . . . . 0.0 112.132 179.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -80.49 -38.11 30.47 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.908 1.283 . . . . 0.0 113.547 175.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 143.96 179.08 20.22 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.781 1.657 . . . . 0.0 114.078 -179.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.88 66.86 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 126.251 1.82 . . . . 0.0 111.74 -173.048 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 47.5 74.79 0.22 Allowed Glycine 0 CA--C 1.543 1.787 0 C-N-CA 126.09 1.805 . . . . 0.0 113.789 -175.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.95 128.69 17.17 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.527 2.818 . . . . 0.0 112.008 -174.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -158.92 109.96 2.08 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.918 1.687 . . . . 0.0 110.197 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 5.5 p -95.24 137.27 22.16 Favored Pre-proline 0 N--CA 1.474 0.74 0 C-N-CA 124.238 1.015 . . . . 0.0 110.514 174.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -73.42 -10.5 23.96 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.771 2.314 . . . . 0.0 114.687 176.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.171 0 C-N-CA 125.264 1.426 . . . . 0.0 113.723 -177.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.55 0.951 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -91.81 0.75 57.47 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.249 1.419 . . . . 0.0 113.489 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.6 p -101.52 162.93 18.92 Favored Pre-proline 0 N--CA 1.475 0.822 0 C-N-CA 127.125 2.17 . . . . 0.0 112.825 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -70.59 170.05 18.5 Favored 'Trans proline' 0 CA--C 1.544 0.99 0 C-N-CA 123.481 2.787 . . . . 0.0 112.223 176.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -66.64 116.67 4.22 Favored 'Trans proline' 0 CA--C 1.547 1.125 0 C-N-CA 123.145 2.564 . . . . 0.0 111.88 172.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -71.23 -23.58 24.22 Favored 'Trans proline' 0 CA--C 1.554 1.476 0 C-N-CA 122.32 2.013 . . . . 0.0 116.888 167.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -71.97 168.91 22.62 Favored 'Trans proline' 0 C--N 1.361 1.232 0 CA-C-N 124.26 2.557 . . . . 0.0 113.156 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -61.93 130.08 29.72 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.831 2.354 . . . . 0.0 110.988 173.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -55.04 -42.53 72.77 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.922 0.868 . . . . 0.0 111.632 174.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -78.73 17.02 0.75 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 127.991 2.516 . . . . 0.0 115.363 177.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -33.25 103.61 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 127.24 2.216 . . . . 0.0 115.325 -173.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.45 32.87 0.11 Allowed Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.095 1.331 . . . . 0.0 114.548 -172.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -125.23 157.79 66.12 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 125.621 1.568 . . . . 0.0 112.021 -175.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -74.44 169.08 23.32 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.065 2.51 . . . . 0.0 113.053 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -53.55 -37.29 62.74 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.65 1.18 . . . . 0.0 113.465 -177.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -57.27 -37.68 72.74 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.278 1.431 . . . . 0.0 112.671 176.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.0 t -82.65 -38.2 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.401 1.481 . . . . 0.0 112.194 174.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.1 t -57.56 -39.33 68.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.936 0.894 . . . . 0.0 110.742 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.5 tptm -61.13 -50.58 72.61 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.653 -1.28 . . . . 0.0 111.799 173.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -53.83 -47.27 71.09 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.237 0.615 . . . . 0.0 112.268 176.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -51.9 -52.97 46.11 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.388 1.075 . . . . 0.0 112.081 169.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -47.47 85.77 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.953 0.901 . . . . 0.0 113.331 -177.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.81 -38.89 92.79 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.422 0.689 . . . . 0.0 111.529 177.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 14.0 tp -63.71 -44.49 93.49 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 122.938 0.495 . . . . 0.0 111.969 172.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.58 -34.88 78.79 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.887 1.275 . . . . 0.0 113.871 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.9 mmtt -54.66 -32.95 59.97 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.844 1.202 . . . . 0.0 113.991 174.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.9 ttpp -69.1 -38.56 79.0 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.88 1.272 . . . . 0.0 112.715 172.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -104.17 14.35 30.6 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.709 1.604 . . . . 0.0 113.245 -172.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -22.3 41.58 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 120.33 -1.481 . . . . 0.0 114.694 -175.161 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.7 p -103.67 1.16 31.56 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 127.123 2.169 . . . . 0.0 114.847 179.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -76.81 170.65 16.08 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.39 1.476 . . . . 0.0 111.96 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.29 171.76 12.42 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.888 1.675 . . . . 0.0 111.915 175.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -50.97 -59.72 6.99 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 124.75 1.22 . . . . 0.0 112.218 174.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -67.03 -28.86 41.11 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.296 1.997 . . . . 0.0 113.479 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -67.53 -50.05 60.51 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.064 -1.648 . . . . 0.0 112.586 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.7 mt -62.97 -53.4 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 CA-C-N 118.662 0.665 . . . . 0.0 110.022 176.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -55.33 -42.33 73.65 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 117.866 -1.064 . . . . 0.0 111.244 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -57.56 -51.39 69.69 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-N 119.672 1.124 . . . . 0.0 112.066 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -40.74 96.63 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.433 HD11 ' HE1' ' A' ' 43' ' ' TRP . 3.2 mm? -61.13 -51.12 70.41 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.687 0.795 . . . . 0.0 111.789 172.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.85 -30.45 71.51 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.149 -0.97 . . . . 0.0 113.106 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.16 -49.05 78.8 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.129 -0.982 . . . . 0.0 112.346 178.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.433 ' HE1' HD11 ' A' ' 40' ' ' LEU . 10.8 p-90 -73.72 -35.52 65.11 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 173.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.65 -30.68 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 124.898 1.279 . . . . 0.0 112.401 176.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -57.27 -14.51 4.48 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.909 0.884 . . . . 0.0 112.912 174.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.79 -12.11 16.0 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.645 1.578 . . . . 0.0 113.833 176.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 17.5 mt -67.67 -54.38 20.07 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 176.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -154.2 -153.08 6.3 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 125.441 1.496 . . . . 0.0 111.224 -169.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.42 13.57 5.4 Favored Glycine 0 CA--C 1.528 0.899 0 N-CA-C 116.49 1.356 . . . . 0.0 116.49 -172.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -112.04 -35.1 5.77 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.396 1.479 . . . . 0.0 111.988 175.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -76.21 -26.83 56.5 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.18 0.592 . . . . 0.0 111.974 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -53.84 -35.04 61.05 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.613 1.565 . . . . 0.0 114.126 172.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.06 -50.71 67.32 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.221 0.608 . . . . 0.0 110.342 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -48.96 -46.34 43.28 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 117.525 -1.226 . . . . 0.0 111.864 170.095 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -55.55 -48.05 75.37 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 119.869 1.213 . . . . 0.0 112.981 174.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -58.05 -46.44 85.39 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.456 1.025 . . . . 0.0 112.246 178.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.7 -41.62 83.3 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.744 1.218 . . . . 0.0 114.078 178.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -72.79 -43.29 62.97 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 121.214 -0.929 . . . . 0.0 113.075 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -53.17 -51.02 63.38 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.873 0.869 . . . . 0.0 111.253 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.1 pttp -63.46 -43.23 97.96 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 118.5 -0.762 . . . . 0.0 112.355 175.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -57.53 -47.41 82.08 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 119.639 1.109 . . . . 0.0 112.635 173.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -61.08 -53.5 56.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.829 1.252 . . . . 0.0 111.989 178.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.9 mtmt -60.14 -31.89 70.51 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 119.032 -0.509 . . . . 0.0 112.344 175.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.43 -51.47 23.74 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.837 0.744 . . . . 0.0 111.455 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -58.76 -49.29 78.19 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.744 0.817 . . . . 0.0 110.791 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -60.96 -52.27 65.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.773 1.229 . . . . 0.0 112.131 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.8 -44.7 96.35 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 119.797 1.18 . . . . 0.0 113.258 179.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -67.53 -45.08 76.77 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.456 0.703 . . . . 0.0 111.954 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.01 -51.23 70.1 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.119 0.967 . . . . 0.0 110.949 170.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.4 -42.93 99.52 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.057 -179.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -56.31 -50.76 70.53 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.558 1.072 . . . . 0.0 111.965 173.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.55 82.05 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -60.65 -49.44 77.51 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.049 0.94 . . . . 0.0 111.046 176.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.63 -42.64 83.79 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.086 1.354 . . . . 0.0 112.993 175.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -56.25 -52.59 63.91 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.324 1.05 . . . . 0.0 112.171 172.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.88 -31.52 72.17 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 177.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.1 t -73.06 -24.8 21.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 125.812 1.645 . . . . 0.0 113.086 176.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.65 -30.59 65.54 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 177.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.2 1.28 54.8 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.729 1.611 . . . . 0.0 114.406 172.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.3 ttm -103.53 -158.57 0.67 Allowed 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 126.429 1.891 . . . . 0.0 111.558 -172.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.76 156.11 36.65 Favored Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 125.179 1.391 . . . . 0.0 113.958 178.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.65 -43.86 1.21 Allowed 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 123.44 2.76 . . . . 0.0 113.084 -176.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -58.97 -34.3 71.65 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.329 1.052 . . . . 0.0 112.107 175.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.72 -43.59 88.61 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 122.998 0.519 . . . . 0.0 110.241 177.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -42.82 77.26 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.219 1.008 . . . . 0.0 112.056 173.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -59.83 -54.29 47.99 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.466 1.107 . . . . 0.0 111.563 175.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.43 -51.52 69.53 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.232 1.013 . . . . 0.0 113.085 178.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.6 -34.83 76.45 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 179.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.35 -51.67 68.95 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.46 1.027 . . . . 0.0 109.92 172.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -52.93 -51.96 59.5 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.808 0.843 . . . . 0.0 111.947 173.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.27 -37.86 84.65 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.7 t -72.98 -37.72 66.92 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.282 1.033 . . . . 0.0 112.541 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -38.86 56.73 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 121.706 -0.621 . . . . 0.0 111.694 177.35 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 12.0 tt -70.71 -31.62 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 119.148 0.886 . . . . 0.0 112.778 175.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.11 -33.38 67.28 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -88.25 -28.28 21.22 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.147 0.979 . . . . 0.0 113.559 171.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -126.58 88.08 2.77 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.025 1.73 . . . . 0.0 112.465 -172.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.89 -8.41 15.34 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 176.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.2 t -66.38 -17.12 64.59 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.232 1.413 . . . . 0.0 114.428 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 5.6 mt -82.58 84.26 7.31 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.008 1.723 . . . . 0.0 110.945 -178.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -88.82 154.53 20.19 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.285 1.034 . . . . 0.0 111.61 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 66.89 7.46 42.94 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.771 1.177 . . . . 0.0 115.761 -178.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -61.22 -28.47 43.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 118.75 1.275 . . . . 0.0 112.911 -170.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -48.52 -38.93 21.58 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.411 1.085 . . . . 0.0 113.36 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -59.3 -59.35 5.6 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.845 0.858 . . . . 0.0 111.626 174.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.89 -33.38 75.69 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -177.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.59 -51.02 71.68 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.645 1.178 . . . . 0.0 110.53 171.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -52.75 -51.88 58.78 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 117.715 -1.136 . . . . 0.0 111.095 172.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 10.4 mm -53.68 -48.5 60.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.284 0.947 . . . . 0.0 111.582 177.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -65.08 -44.11 89.99 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.31 -0.869 . . . . 0.0 113.209 178.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.08 78.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.951 0.9 . . . . 0.0 112.126 177.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.49 -37.15 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 122.853 0.461 . . . . 0.0 111.891 175.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -58.42 -44.12 88.97 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 119.458 1.026 . . . . 0.0 112.194 176.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 8.1 mmtt -67.41 -15.7 63.82 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.554 1.142 . . . . 0.0 113.475 176.134 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 59.2 p -106.09 3.14 27.78 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.58 1.152 . . . . 0.0 113.961 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 51.4 mt -65.34 157.48 77.51 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 124.762 1.225 . . . . 0.0 113.393 177.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -71.67 161.86 43.9 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 123.414 2.743 . . . . 0.0 112.932 177.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -63.98 -24.89 67.89 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.547 -0.721 . . . . 0.0 112.865 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.9 t -61.22 -51.64 68.14 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.229 -0.919 . . . . 0.0 111.981 177.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.1 p -73.97 -38.12 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 121.737 -0.602 . . . . 0.0 112.051 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.47 -48.84 76.26 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.073 0.851 . . . . 0.0 111.706 171.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -67.93 -42.5 80.94 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.306 0.957 . . . . 0.0 112.96 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -65.99 -34.25 77.67 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.137 0.881 . . . . 0.0 112.592 177.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.08 -22.82 25.18 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 178.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -55.07 -31.13 60.93 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.511 1.525 . . . . 0.0 113.011 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -59.07 -31.56 68.98 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.246 1.018 . . . . 0.0 112.58 173.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 70.14 38.76 72.93 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 125.072 1.32 . . . . 0.0 114.705 176.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER 37.44 52.51 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 C-N-CA 128.059 2.544 . . . . 0.0 114.222 178.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 61.1 74.81 0.34 Allowed Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.64 1.59 . . . . 0.0 112.342 -174.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -73.79 -29.09 10.84 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.614 2.876 . . . . 0.0 112.584 -170.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -160.0 114.08 2.24 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 127.227 2.211 . . . . 0.0 109.349 172.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 41.0 t -95.46 130.71 31.36 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 124.699 1.2 . . . . 0.0 109.613 176.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -70.13 174.28 10.06 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 123.549 2.833 . . . . 0.0 112.775 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.212 0 C-N-CA 124.023 0.929 . . . . 0.0 113.267 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 34.3 t70 . . . . . 0 N--CA 1.472 0.633 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.7 -153.38 0.2 Allowed 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 125.585 1.554 . . . . 0.0 113.161 176.198 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.86 158.49 72.29 Favored Pre-proline 0 N--CA 1.478 0.961 0 C-N-CA 125.637 1.575 . . . . 0.0 111.721 171.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -68.12 167.68 21.2 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.47 2.78 . . . . 0.0 113.124 178.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -64.46 126.38 16.81 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 123.953 3.102 . . . . 0.0 111.633 175.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -67.64 -24.77 41.14 Favored 'Trans proline' 0 CA--C 1.554 1.497 0 C-N-CA 122.669 2.246 . . . . 0.0 116.492 167.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.6 166.36 26.16 Favored 'Trans proline' 0 C--N 1.361 1.223 0 CA-C-N 124.093 2.497 . . . . 0.0 112.8 175.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.445 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 35.0 Cg_endo -59.15 131.3 40.54 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 123.099 2.533 . . . . 0.0 111.626 171.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -48.4 -47.22 37.87 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.415 0.686 . . . . 0.0 111.818 170.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -83.47 18.06 1.96 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 126.6 1.96 . . . . 0.0 115.219 -178.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -32.92 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 127.018 2.127 . . . . 0.0 115.611 -172.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.09 27.71 0.17 Allowed Glycine 0 CA--C 1.537 1.453 0 C-N-CA 124.814 1.197 . . . . 0.0 114.448 -172.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.79 157.45 59.84 Favored Pre-proline 0 CA--C 1.552 1.036 0 C-N-CA 125.722 1.609 . . . . 0.0 111.663 -175.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -73.36 168.37 24.94 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.114 2.543 . . . . 0.0 112.923 -178.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -54.76 -38.24 66.97 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.532 1.133 . . . . 0.0 113.464 -177.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.76 -40.9 66.61 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.517 1.527 . . . . 0.0 112.428 173.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.1 t -80.69 -39.52 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 124.812 1.245 . . . . 0.0 111.683 176.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 59.5 t -56.28 -40.91 68.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.077 0.951 . . . . 0.0 111.105 177.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.7 tptm -61.28 -50.69 72.01 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 121.132 -0.98 . . . . 0.0 111.968 173.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -53.36 -47.58 69.29 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.531 0.733 . . . . 0.0 112.042 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.445 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -52.06 -53.79 38.02 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.676 1.191 . . . . 0.0 112.156 169.742 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.33 -47.61 84.77 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.27 0.941 . . . . 0.0 113.533 -178.305 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -68.61 -28.76 67.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.477 0.711 . . . . 0.0 112.295 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.3 tp -68.75 -48.53 63.51 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 121.56 -0.713 . . . . 0.0 111.668 165.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.71 -34.65 73.18 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.652 1.581 . . . . 0.0 113.905 -178.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -30.72 47.42 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.924 1.238 . . . . 0.0 113.099 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.4 -34.33 70.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.882 1.673 . . . . 0.0 112.372 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -109.85 16.84 21.73 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.952 2.101 . . . . 0.0 113.15 -175.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -20.59 56.65 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 119.974 -1.704 . . . . 0.0 114.529 -174.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.1 m -102.24 0.77 34.95 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.849 2.06 . . . . 0.0 113.086 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -74.33 175.96 7.15 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.23 1.412 . . . . 0.0 111.875 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.65 174.7 6.86 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.4 1.88 . . . . 0.0 111.902 175.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.78 -60.69 3.84 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 126.539 1.935 . . . . 0.0 112.774 172.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.85 -33.77 25.88 Favored 'Trans proline' 0 C--N 1.357 1.014 0 C-N-CA 121.881 1.721 . . . . 0.0 113.284 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -65.06 -46.16 82.32 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.118 -0.989 . . . . 0.0 112.224 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 66.7 mt -67.73 -53.29 32.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 122.931 0.493 . . . . 0.0 110.371 175.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -56.38 -38.33 71.3 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 118.403 0.547 . . . . 0.0 111.835 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -58.19 -57.17 14.02 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 125.227 1.411 . . . . 0.0 113.016 173.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -65.8 -35.47 80.79 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.756 0.312 . . . . 0.0 111.672 -175.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -64.54 -49.46 71.16 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.977 1.311 . . . . 0.0 111.732 170.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.26 -41.0 71.61 Favored 'General case' 0 N--CA 1.465 0.319 0 O-C-N 121.177 -0.952 . . . . 0.0 113.303 174.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.64 -48.7 71.95 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -175.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 8.1 p-90 -72.92 -36.01 67.16 Favored 'General case' 0 CA--C 1.554 1.119 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 168.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -32.85 39.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 125.258 1.423 . . . . 0.0 112.364 175.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -60.1 -15.63 25.04 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.827 0.851 . . . . 0.0 112.762 177.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 21.5 m -100.88 -17.99 16.58 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.414 1.486 . . . . 0.0 112.614 176.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 17.8 mt -63.73 -52.16 61.7 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 178.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -176.9 -166.75 34.4 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 123.73 0.681 . . . . 0.0 112.558 -165.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -122.95 12.69 8.61 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 125.603 1.573 . . . . 0.0 114.5 -175.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -106.05 -32.65 8.19 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.664 2.385 . . . . 0.0 112.46 173.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -71.95 -22.23 61.48 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 121.317 -0.864 . . . . 0.0 112.482 176.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.99 -34.31 59.46 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.373 1.469 . . . . 0.0 114.248 171.242 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.98 -38.61 82.92 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.625 0.77 . . . . 0.0 111.717 178.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.44 -44.89 92.83 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.425 -0.797 . . . . 0.0 111.551 169.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -57.57 -47.82 81.04 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.253 0.933 . . . . 0.0 113.054 173.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -43.97 90.76 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.646 0.657 . . . . 0.0 111.248 -179.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.07 -37.5 66.77 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.011 0.524 . . . . 0.0 112.312 -178.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -63.64 -55.53 22.85 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 123.77 0.828 . . . . 0.0 111.43 174.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -54.5 -39.79 67.9 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 118.641 0.655 . . . . 0.0 111.871 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.1 mmtt -59.37 -57.22 13.96 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.925 1.29 . . . . 0.0 113.876 170.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -59.47 -41.87 90.74 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 118.57 0.623 . . . . 0.0 112.381 178.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -51.93 64.02 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 124.866 1.266 . . . . 0.0 112.502 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -55.68 -38.65 69.92 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.918 0.887 . . . . 0.0 111.038 172.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.64 -46.92 67.92 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 123.117 0.567 . . . . 0.0 111.884 -178.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -59.57 -53.26 60.16 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.249 1.02 . . . . 0.0 111.581 175.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.2 -38.27 89.94 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.71 -50.85 69.49 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.316 0.962 . . . . 0.0 112.409 175.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.98 -44.61 84.42 Favored 'General case' 0 C--O 1.245 0.816 0 C-N-CA 123.197 0.599 . . . . 0.0 112.037 -178.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 26.6 mt -59.13 -51.29 70.66 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 124.297 1.039 . . . . 0.0 111.788 173.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.13 -40.87 97.38 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.996 179.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.8 tttm -58.29 -51.11 71.17 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.098 1.317 . . . . 0.0 111.994 174.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.0 -48.77 78.83 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.27 0.628 . . . . 0.0 112.44 177.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -58.87 -50.04 75.51 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.306 1.042 . . . . 0.0 110.941 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.11 -41.72 84.19 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.332 1.453 . . . . 0.0 113.269 175.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -55.76 -52.58 63.45 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.55 1.14 . . . . 0.0 112.209 172.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.55 -31.84 72.19 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 54.1 t -73.26 -24.27 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 C-N-CA 125.512 1.525 . . . . 0.0 112.783 176.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.68 -34.62 65.2 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 176.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.9 pttt -84.4 0.18 50.43 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.297 1.439 . . . . 0.0 114.349 174.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.7 ttm -103.0 -159.64 0.74 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.947 2.099 . . . . 0.0 111.445 -173.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -58.72 154.78 34.19 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 125.339 1.456 . . . . 0.0 113.665 178.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -68.51 -45.73 2.34 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.573 2.849 . . . . 0.0 112.762 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -33.48 72.63 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.966 1.306 . . . . 0.0 112.893 176.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.97 -48.72 75.32 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 122.795 0.438 . . . . 0.0 110.218 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.2 -44.84 68.28 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.95 173.365 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -59.44 -55.44 34.58 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.522 1.055 . . . . 0.0 110.903 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.89 -51.49 69.38 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.242 0.617 . . . . 0.0 112.251 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.75 -39.25 93.83 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.5 -44.44 94.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.26 0.936 . . . . 0.0 111.104 174.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.55 -45.42 88.99 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.502 0.721 . . . . 0.0 112.782 172.07 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 7.8 mp -64.47 -34.77 78.97 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.888 0.767 . . . . 0.0 112.372 173.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 15.6 t -70.9 -45.12 64.88 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 120.686 -1.259 . . . . 0.0 112.903 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? -66.47 -49.24 67.28 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.225 0.61 . . . . 0.0 109.987 175.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.1 tt -65.32 -32.39 58.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 118.958 0.799 . . . . 0.0 112.509 -176.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.34 -19.4 63.31 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -115.48 -22.99 9.02 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 170.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -126.56 79.88 1.89 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.172 1.389 . . . . 0.0 108.888 -177.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -65.16 -31.77 73.12 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.817 1.247 . . . . 0.0 112.386 -178.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.6 m -73.09 -18.07 61.34 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 126.184 1.794 . . . . 0.0 114.53 177.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -77.73 84.16 4.07 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 124.834 1.253 . . . . 0.0 109.364 175.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -93.12 -170.29 2.37 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.172 1.789 . . . . 0.0 111.405 173.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 93.38 -59.09 2.28 Favored Glycine 0 N--CA 1.466 0.664 0 C-N-CA 124.949 1.262 . . . . 0.0 111.5 178.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -24.35 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 125.079 1.352 . . . . 0.0 113.466 -177.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -46.94 -32.49 3.88 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.217 1.407 . . . . 0.0 113.247 169.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -55.56 -60.09 3.91 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.119 0.967 . . . . 0.0 111.336 169.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.99 -34.05 77.22 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.212 -0.93 . . . . 0.0 112.332 -176.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.71 -54.58 42.56 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.866 0.866 . . . . 0.0 110.83 171.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -56.06 -52.49 64.08 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 118.375 -0.821 . . . . 0.0 112.062 174.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.9 mm -51.84 -49.19 37.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.208 1.403 . . . . 0.0 111.073 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -67.15 -43.77 81.48 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.683 1.129 . . . . 0.0 112.842 178.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.14 -49.19 78.82 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.83 0.852 . . . . 0.0 111.319 177.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.4 pp -68.76 -37.3 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 118.615 -0.707 . . . . 0.0 112.247 174.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -56.06 -41.05 74.49 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.744 1.218 . . . . 0.0 112.68 177.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -69.02 -18.11 64.0 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 176.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 6.4 t -117.45 22.05 12.67 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.971 1.309 . . . . 0.0 112.907 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 36.4 mt -59.72 151.67 61.54 Favored Pre-proline 0 CA--C 1.546 0.826 0 O-C-N 120.849 -1.157 . . . . 0.0 113.218 177.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -70.16 159.13 54.18 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.377 2.718 . . . . 0.0 112.548 -179.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.06 -23.95 66.8 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.912 176.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 61.3 m -68.72 -39.22 80.51 Favored 'General case' 0 C--N 1.352 0.677 0 CA-C-O 117.346 -1.312 . . . . 0.0 114.217 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.3 p -79.6 -37.82 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-N 119.098 0.863 . . . . 0.0 110.189 175.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -57.55 -48.26 79.8 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.126 0.875 . . . . 0.0 111.669 173.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -68.34 -43.01 78.45 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.086 0.857 . . . . 0.0 112.541 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -64.95 -32.87 74.8 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.251 -0.905 . . . . 0.0 112.859 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.86 -19.94 22.83 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.355 1.062 . . . . 0.0 113.418 179.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.9 -29.12 55.18 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.084 1.354 . . . . 0.0 112.815 178.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 12.6 tmtt? -65.13 -26.13 68.06 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.565 1.546 . . . . 0.0 113.502 174.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -161.38 91.41 0.11 Allowed Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.749 1.166 . . . . 0.0 114.207 -172.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -88.14 68.02 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 127.229 2.211 . . . . 0.0 112.546 -178.153 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 46.52 77.78 0.1 OUTLIER Glycine 0 CA--C 1.544 1.892 0 C-N-CA 126.834 2.159 . . . . 0.0 113.185 -177.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.02 101.88 1.27 Allowed 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 123.931 3.087 . . . . 0.0 112.689 -171.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -156.87 110.92 2.69 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.207 1.803 . . . . 0.0 111.267 179.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 12.6 p -70.11 132.87 88.01 Favored Pre-proline 0 N--CA 1.476 0.85 0 C-N-CA 124.823 1.249 . . . . 0.0 111.002 173.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -73.15 179.1 5.75 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 123.234 2.623 . . . . 0.0 112.516 176.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 C--O 1.253 1.247 0 C-N-CA 125.224 1.41 . . . . 0.0 113.359 176.002 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo . . . . . 0 CA--C 1.548 1.176 0 CA-C-O 119.032 -0.487 . . . . 0.0 112.043 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -73.7 -19.08 21.65 Favored 'Trans proline' 0 CA--C 1.554 1.493 0 C-N-CA 122.438 2.092 . . . . 0.0 116.604 165.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.78 168.39 23.91 Favored 'Trans proline' 0 C--N 1.362 1.24 0 CA-C-N 124.462 2.629 . . . . 0.0 112.353 176.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -60.44 127.96 24.51 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.673 2.249 . . . . 0.0 111.181 170.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -51.88 -41.71 62.12 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.522 0.677 . . . . 0.0 111.747 168.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.704 HD13 ' H ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -95.86 41.87 1.1 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 128.62 2.768 . . . . 0.0 112.954 176.772 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.6 112.68 0.58 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.873 1.269 . . . . 0.0 113.039 174.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.15 -16.45 2.12 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 126.128 1.823 . . . . 0.0 114.236 -177.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.05 160.42 78.37 Favored Pre-proline 0 CA--C 1.558 1.274 0 C-N-CA 125.535 1.534 . . . . 0.0 113.866 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -75.71 171.34 18.38 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.899 3.066 . . . . 0.0 113.545 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -53.86 -36.62 62.82 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.463 1.105 . . . . 0.0 113.785 -176.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -53.4 -42.34 66.87 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.711 1.604 . . . . 0.0 112.551 173.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 77.8 t -77.47 -41.55 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 124.649 1.18 . . . . 0.0 111.673 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.3 t -55.24 -37.81 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 118.641 0.655 . . . . 0.0 111.583 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.0 tptm -62.48 -50.67 70.49 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.245 -0.909 . . . . 0.0 111.865 172.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.49 -46.51 80.43 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.003 0.82 . . . . 0.0 112.515 176.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -53.84 49.17 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.775 0.83 . . . . 0.0 111.527 172.147 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -64.03 -44.93 91.05 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.521 1.055 . . . . 0.0 113.209 -178.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.42 -37.97 82.57 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.248 1.019 . . . . 0.0 111.589 177.726 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.445 HD23 HD22 ' A' ' 40' ' ' LEU . 12.6 tp -66.7 -46.02 76.92 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 122.966 0.506 . . . . 0.0 111.259 169.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.628 HD12 HD21 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -64.63 -42.53 95.41 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -178.666 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.36 -29.34 61.29 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.993 1.27 . . . . 0.0 113.361 177.564 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.7 tttp -72.67 -33.95 66.89 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.686 1.195 . . . . 0.0 112.989 175.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . 0.285 15.9 p30 -109.78 22.1 16.09 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.983 1.313 . . . . 0.0 113.934 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -58.72 -24.54 61.66 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.05 -1.656 . . . . 0.0 113.178 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 31.9 p -96.87 -0.89 47.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 127.522 2.329 . . . . 0.0 114.388 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -77.87 179.72 6.54 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.876 1.671 . . . . 0.0 112.969 173.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.86 171.5 9.56 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.378 2.271 . . . . 0.0 112.503 173.683 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -59.13 8.76 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 125.413 1.485 . . . . 0.0 112.556 175.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -66.43 -28.41 46.27 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 122.254 1.97 . . . . 0.0 113.65 -178.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -72.71 -39.89 66.6 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.439 -0.788 . . . . 0.0 111.669 -176.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 52.7 mt -70.52 -53.04 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.669 1.188 . . . . 0.0 110.21 171.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -57.97 -36.83 73.14 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 118.39 -0.814 . . . . 0.0 112.051 -176.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -52.79 -57.28 10.7 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.078 1.351 . . . . 0.0 111.77 172.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.38 -41.37 96.99 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.5 0.72 . . . . 0.0 111.691 -177.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.748 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.8 mm? -61.45 -47.45 85.67 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.001 0.92 . . . . 0.0 111.384 174.217 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -62.46 -38.6 90.43 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.323 1.049 . . . . 0.0 113.105 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.33 -49.93 68.58 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.405 -0.809 . . . . 0.0 112.578 179.026 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.748 ' HE1' HD13 ' A' ' 40' ' ' LEU . 7.6 p-90 -73.73 -33.93 64.54 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 172.535 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.549 HG23 HD12 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -58.44 -30.39 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 125.074 1.35 . . . . 0.0 112.82 174.538 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.83 -16.66 18.23 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 118.836 0.743 . . . . 0.0 112.875 176.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.44 -16.21 21.32 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.189 1.396 . . . . 0.0 113.902 173.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.628 HD11 ' CH2' ' A' ' 43' ' ' TRP . 40.2 mt . . . . . 0 N--CA 1.474 0.75 0 CA-C-N 119.024 0.829 . . . . 0.0 112.629 175.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 N--CA 1.476 0.846 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -61.5 -53.32 57.92 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 124.375 1.07 . . . . 0.0 112.156 177.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt -56.08 -35.6 67.16 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.574 0.749 . . . . 0.0 111.661 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.72 -50.57 34.85 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.838 0.855 . . . . 0.0 111.48 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.8 tttt -58.83 -49.71 76.7 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.554 0.742 . . . . 0.0 110.688 176.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -62.31 -49.16 76.74 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.636 0.774 . . . . 0.0 111.954 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.01 -44.55 94.5 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.006 0.821 . . . . 0.0 111.9 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -66.72 -46.27 76.03 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.601 0.761 . . . . 0.0 112.224 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.8 tt -54.93 -51.13 67.06 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.804 0.842 . . . . 0.0 111.166 169.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.52 -40.09 96.13 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 118.553 -0.736 . . . . 0.0 112.176 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -57.77 -50.92 71.63 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.724 1.21 . . . . 0.0 111.929 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.15 -48.56 73.13 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.314 0.646 . . . . 0.0 112.156 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -59.33 -48.91 79.83 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.161 0.984 . . . . 0.0 110.708 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -55.65 -46.36 77.48 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.763 1.225 . . . . 0.0 113.039 173.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -51.69 65.69 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.174 0.897 . . . . 0.0 111.772 176.24 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.43 -32.93 74.81 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 175.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 48.8 t -72.69 -25.42 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 125.312 1.445 . . . . 0.0 113.139 178.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.85 -29.63 67.1 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.1 ptmt -89.24 -3.19 58.64 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.863 1.665 . . . . 0.0 114.16 172.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.7 tpp -94.74 -163.54 1.06 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.339 1.856 . . . . 0.0 112.018 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -52.64 152.18 7.02 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 126.94 2.096 . . . . 0.0 114.118 172.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -72.52 -39.11 2.89 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.697 2.932 . . . . 0.0 113.876 -174.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -62.86 -33.04 74.44 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.102 -0.999 . . . . 0.0 112.437 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.26 -44.06 92.93 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.902 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.04 -42.63 65.92 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.098 1.359 . . . . 0.0 112.634 173.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.3 mmtm -65.5 -52.62 51.42 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.279 1.432 . . . . 0.0 111.681 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.87 -53.16 60.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.501 0.72 . . . . 0.0 112.16 173.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.31 -36.0 82.69 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.11 -48.48 81.53 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.133 0.879 . . . . 0.0 111.216 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -56.64 -49.58 74.6 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 171.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.2 mt -60.7 -35.17 75.62 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.543 0.737 . . . . 0.0 112.296 178.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.4 t -73.05 -46.55 51.11 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.678 1.191 . . . . 0.0 113.043 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -65.97 -43.03 89.05 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.514 -0.741 . . . . 0.0 110.89 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.1 tt -68.95 -34.62 65.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.88 -18.06 63.81 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 . . . . . 0 N--CA 1.474 0.753 0 C-N-CA 124.282 1.033 . . . . 0.0 113.732 169.592 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.491 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -48.72 -38.06 20.49 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.218 -0.926 . . . . 0.0 112.554 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -58.93 -59.33 5.63 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.289 0.636 . . . . 0.0 111.225 173.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.491 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.64 -35.37 80.79 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.934 0.788 . . . . 0.0 112.623 -176.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 9.0 tm0? -59.09 -46.25 88.77 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.926 0.89 . . . . 0.0 111.554 171.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -50.35 74.03 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.396 -0.812 . . . . 0.0 111.494 173.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 31.0 mm -51.11 -50.84 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 124.793 1.237 . . . . 0.0 110.797 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -64.03 -45.99 86.45 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.604 0.638 . . . . 0.0 112.053 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.15 -44.78 83.75 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.501 0.72 . . . . 0.0 111.8 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 28.0 pt -71.54 -41.11 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-O 118.746 -0.645 . . . . 0.0 112.556 173.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 90.5 t80 . . . . . 0 N--CA 1.474 0.757 0 CA-C-N 120.362 1.437 . . . . 0.0 112.857 -178.329 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 CA--C 1.536 0.609 0 CA-C-O 121.735 0.639 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -63.2 -23.39 67.41 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.317 -0.865 . . . . 0.0 112.791 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.3 m -62.44 -51.7 66.48 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.318 0.963 . . . . 0.0 112.118 176.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.476 HG22 HD23 ' A' ' 124' ' ' LEU . 10.8 p -72.23 -39.96 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 118.249 0.477 . . . . 0.0 111.414 178.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.82 -46.42 84.73 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.779 173.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -69.18 -40.27 78.19 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.605 1.093 . . . . 0.0 113.438 177.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -68.65 -31.28 70.31 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 121.039 -1.038 . . . . 0.0 113.055 177.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.476 HD23 HG22 ' A' ' 120' ' ' VAL . 0.6 OUTLIER -93.34 -16.95 24.11 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.447 1.099 . . . . 0.0 113.594 178.486 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 N--CA 1.476 0.842 0 C-N-CA 124.939 1.296 . . . . 0.0 112.367 174.945 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo . . . . . 0 CA--C 1.543 0.927 0 CA-C-O 119.29 -0.379 . . . . 0.0 111.648 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.81 -25.29 39.54 Favored 'Trans proline' 0 CA--C 1.551 1.368 0 C-N-CA 122.442 2.095 . . . . 0.0 116.367 167.167 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.4 163.87 34.85 Favored 'Trans proline' 0 C--N 1.362 1.254 0 CA-C-N 124.116 2.506 . . . . 0.0 112.754 176.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 36.8 Cg_endo -61.4 133.81 48.17 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.9 2.4 . . . . 0.0 111.34 171.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -49.9 -43.67 49.67 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.335 0.654 . . . . 0.0 111.669 169.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.551 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.8 pt? -83.06 18.91 1.53 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.216 1.807 . . . . 0.0 115.102 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.36 105.59 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.625 1.97 . . . . 0.0 115.24 -173.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.28 26.68 0.2 Allowed Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.757 1.17 . . . . 0.0 114.661 -172.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -120.97 156.85 56.33 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 126.198 1.799 . . . . 0.0 112.01 -174.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.404 ' O ' HG23 ' A' ' 18' ' ' VAL . 81.8 Cg_endo -73.45 166.39 29.98 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 123.394 2.73 . . . . 0.0 113.239 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -52.46 -41.02 62.96 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.512 1.525 . . . . 0.0 113.133 -179.175 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -55.36 -39.54 70.18 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.883 1.673 . . . . 0.0 113.027 175.111 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 74.8 t -80.35 -40.33 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 124.881 1.273 . . . . 0.0 111.705 175.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 14' ' ' PRO . 54.1 t -55.9 -39.81 58.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.876 0.87 . . . . 0.0 110.987 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -59.72 -50.66 72.96 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 121.002 -1.061 . . . . 0.0 112.178 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.57 -47.02 83.23 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.852 0.861 . . . . 0.0 111.818 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.406 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.9 OUTLIER -51.96 -50.09 61.93 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.498 1.119 . . . . 0.0 111.861 168.182 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -44.82 95.52 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.225 0.92 . . . . 0.0 113.038 -178.151 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -65.85 -34.86 79.13 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.546 -0.721 . . . . 0.0 111.789 176.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 tp -66.64 -41.05 88.87 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 171.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -72.23 -25.56 61.68 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.5 mmtt -53.62 -46.76 70.55 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.583 1.083 . . . . 0.0 113.051 175.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.0 ptmt -70.06 -24.77 63.3 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 173.028 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -104.21 17.56 23.88 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 126.761 2.025 . . . . 0.0 113.008 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.68 -19.07 65.52 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.185 -1.572 . . . . 0.0 113.175 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.2 p -98.6 3.41 47.96 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.871 2.469 . . . . 0.0 114.206 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -73.37 179.61 3.89 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.426 1.49 . . . . 0.0 112.802 173.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -117.65 172.49 7.32 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 127.513 2.325 . . . . 0.0 111.227 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.7 -57.62 6.53 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 126.544 1.938 . . . . 0.0 112.826 176.35 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -69.73 -37.33 9.38 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.349 2.033 . . . . 0.0 113.426 177.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -64.79 -41.57 95.72 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 120.788 -1.195 . . . . 0.0 112.269 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 56.8 mt -67.14 -53.29 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-O 118.431 -0.795 . . . . 0.0 109.428 174.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -57.39 -41.04 79.5 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.555 1.071 . . . . 0.0 112.187 -175.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 6.5 mmpt? -57.14 -60.79 3.08 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.3 1.44 . . . . 0.0 112.806 174.382 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.14 -33.96 77.27 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -174.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.711 HD13 ' HE1' ' A' ' 43' ' ' TRP . 0.9 OUTLIER -66.93 -50.14 63.31 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 124.649 1.179 . . . . 0.0 111.235 173.488 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -55.28 -39.42 69.84 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.983 0.81 . . . . 0.0 112.912 175.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.36 -50.23 67.97 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.711 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.4 p-90 -73.8 -34.5 64.64 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 169.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -56.56 -32.19 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 125.194 1.397 . . . . 0.0 112.193 174.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.28 -19.27 44.74 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 118.935 0.789 . . . . 0.0 112.686 177.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 48.9 m -89.95 -24.49 21.28 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.983 1.313 . . . . 0.0 112.898 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.707 HD11 ' CH2' ' A' ' 43' ' ' TRP . 37.5 mt . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 13.3 mmt -64.27 -50.02 69.57 Favored 'General case' 0 N--CA 1.462 0.169 0 C-N-CA 123.032 0.533 . . . . 0.0 112.174 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -57.38 -35.02 69.46 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.292 0.637 . . . . 0.0 112.197 175.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.83 -51.5 22.14 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.236 1.014 . . . . 0.0 111.805 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -50.98 70.79 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.758 0.823 . . . . 0.0 110.599 174.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -60.88 -50.43 73.47 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.213 0.605 . . . . 0.0 111.99 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.13 92.95 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.803 0.728 . . . . 0.0 112.65 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -64.02 -50.33 68.9 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.772 0.829 . . . . 0.0 112.088 176.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 42.2 mt -55.66 -51.07 68.48 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.417 1.087 . . . . 0.0 110.724 175.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.428 ' HB1' ' HA ' ' A' ' 92' ' ' SER . . . -54.37 -51.35 65.09 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.118 0.967 . . . . 0.0 113.108 172.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -53.16 -50.74 63.97 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 120.218 1.372 . . . . 0.0 112.268 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.29 -48.85 74.1 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.424 0.689 . . . . 0.0 112.35 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.487 ' O ' HG23 ' A' ' 77' ' ' VAL . 8.9 m-70 -55.57 -52.88 62.27 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 123.804 0.842 . . . . 0.0 110.88 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -52.08 -46.96 65.4 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.997 2.119 . . . . 0.0 112.295 177.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -48.55 78.1 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.848 0.859 . . . . 0.0 112.26 174.607 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.63 -33.88 76.63 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 173.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 73' ' ' HIS . 92.6 t -69.98 -28.14 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 125.293 1.437 . . . . 0.0 111.925 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.04 -20.2 37.28 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 176.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.91 1.31 26.6 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 126.299 1.84 . . . . 0.0 114.173 173.28 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 tpp -98.64 -161.59 0.89 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.701 2.001 . . . . 0.0 112.025 -175.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.1 156.5 20.1 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 125.507 1.523 . . . . 0.0 113.942 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.56 -42.55 2.5 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.728 2.952 . . . . 0.0 113.345 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.64 -36.55 83.18 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.899 1.28 . . . . 0.0 112.571 177.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.62 -40.99 89.38 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.756 175.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -56.12 -45.72 79.42 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 117.852 -1.07 . . . . 0.0 112.368 176.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.31 -53.73 50.87 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.375 1.47 . . . . 0.0 111.369 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.63 -55.05 36.66 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.653 0.781 . . . . 0.0 111.885 176.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.25 -32.35 71.5 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -176.405 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.92 -46.38 89.61 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.023 -1.048 . . . . 0.0 111.856 170.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -58.53 -50.42 73.82 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.445 0.698 . . . . 0.0 111.977 171.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.2 mp -57.83 -34.58 69.83 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.646 0.657 . . . . 0.0 111.833 174.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.428 ' HA ' ' HB1' ' A' ' 70' ' ' ALA . 14.5 t -69.82 -50.83 39.01 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.012 -1.055 . . . . 0.0 112.657 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? -64.71 -40.2 94.94 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 118.677 -0.678 . . . . 0.0 110.898 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.5 tp -70.37 -37.15 69.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 119.224 0.92 . . . . 0.0 111.824 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.93 -21.0 65.13 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -176.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.711 0 C-N-CA 124.903 1.281 . . . . 0.0 113.634 174.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -41.3 -46.43 3.23 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.906 1.682 . . . . 0.0 113.025 170.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -59.67 -59.13 5.92 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.615 0.766 . . . . 0.0 111.617 176.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.23 -35.62 80.9 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.671 0.789 . . . . 0.0 112.833 -175.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -53.86 -50.9 65.25 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 124.784 1.233 . . . . 0.0 110.779 167.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.4 tttt -57.29 -49.2 76.84 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.424 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 9.9 mm -54.74 -48.67 72.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.898 0.879 . . . . 0.0 111.758 176.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -64.5 -45.12 88.65 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.296 0.953 . . . . 0.0 112.844 177.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.51 -48.92 79.79 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.433 1.093 . . . . 0.0 111.822 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -68.88 -38.41 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.061 0.544 . . . . 0.0 112.142 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 63.0 t80 . . . . . 0 N--CA 1.472 0.625 0 CA-C-N 119.61 1.095 . . . . 0.0 113.016 177.418 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo . . . . . 0 N--CA 1.458 -0.585 0 N-CA-C 110.45 -0.634 . . . . 0.0 110.45 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -55.05 -30.46 59.63 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.596 -0.69 . . . . 0.0 111.818 176.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 46.7 p -56.69 -50.73 71.26 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.066 1.746 . . . . 0.0 113.202 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.94 -41.79 94.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 CA-C-N 119.619 1.099 . . . . 0.0 110.507 177.367 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -62.55 -46.27 89.15 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.356 177.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.52 -37.86 87.97 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.978 1.263 . . . . 0.0 113.244 176.391 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.74 -37.43 73.46 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.271 -0.893 . . . . 0.0 112.531 177.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -87.02 -19.11 29.14 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.445 1.098 . . . . 0.0 113.272 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.475 0.817 0 C-N-CA 125.789 1.636 . . . . 0.0 112.131 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo . . . . . 0 CA--C 1.544 0.999 0 N-CA-C 110.772 -0.511 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -68.19 -22.54 40.49 Favored 'Trans proline' 0 CA--C 1.552 1.383 0 C-N-CA 122.341 2.027 . . . . 0.0 116.281 167.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -69.89 167.95 23.13 Favored 'Trans proline' 0 C--N 1.362 1.274 0 CA-C-N 124.531 2.654 . . . . 0.0 113.828 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -61.21 119.74 7.05 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 123.629 2.886 . . . . 0.0 111.772 173.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -54.0 -27.87 34.47 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 172.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.478 HD13 ' H ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -108.08 35.34 3.18 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 128.122 2.569 . . . . 0.0 112.693 178.426 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -41.93 112.46 0.33 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.475 1.51 . . . . 0.0 114.044 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 151.42 -17.66 0.89 Allowed Glycine 0 CA--C 1.539 1.553 0 C-N-CA 126.588 2.042 . . . . 0.0 113.929 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.14 159.25 65.65 Favored Pre-proline 0 CA--C 1.553 1.089 0 C-N-CA 125.598 1.559 . . . . 0.0 113.919 -175.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.66 172.19 16.71 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.643 2.895 . . . . 0.0 113.27 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -53.65 -34.07 57.37 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.549 1.139 . . . . 0.0 113.438 -179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.62 -36.08 71.31 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.503 1.521 . . . . 0.0 112.65 175.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.46 HG13 ' HH2' ' A' ' 43' ' ' TRP . 43.3 t -79.14 -43.02 24.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 125.113 1.365 . . . . 0.0 111.553 170.132 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 86.0 t -53.36 -37.9 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 119.035 0.834 . . . . 0.0 111.642 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tppt? -61.14 -51.1 70.49 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.001 -1.062 . . . . 0.0 112.402 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.12 -49.48 76.83 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.668 0.787 . . . . 0.0 111.283 176.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.06 -52.34 44.29 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.33 1.052 . . . . 0.0 111.827 171.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -61.41 -45.47 94.2 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.89 1.223 . . . . 0.0 113.226 -178.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -69.83 -26.42 64.22 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 122.949 0.5 . . . . 0.0 112.282 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -72.84 -54.15 9.56 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.005 0.922 . . . . 0.0 111.903 168.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.22 -43.12 82.54 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.704 1.602 . . . . 0.0 114.131 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.91 -27.11 64.94 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.508 1.049 . . . . 0.0 112.942 175.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -38.08 66.94 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.966 1.706 . . . . 0.0 112.501 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.98 19.47 19.53 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.08 2.152 . . . . 0.0 113.99 177.656 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -59.23 -23.54 62.4 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 119.595 -1.941 . . . . 0.0 113.418 -176.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.2 p -82.14 2.13 32.94 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 128.929 2.892 . . . . 0.0 115.072 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -93.08 -176.06 4.05 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 126.548 1.939 . . . . 0.0 112.417 173.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.45 167.15 11.17 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.31 2.244 . . . . 0.0 111.745 174.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -43.5 -59.8 3.06 Favored Pre-proline 0 N--CA 1.473 0.705 0 C-N-CA 125.704 1.602 . . . . 0.0 113.313 174.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -66.75 -35.82 26.54 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 121.827 1.684 . . . . 0.0 113.642 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.42 -50.77 71.48 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.686 1.194 . . . . 0.0 111.324 -177.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 10.4 mt -66.94 -48.43 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.3 1.04 . . . . 0.0 112.379 172.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -49.49 -46.07 47.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.643 0.777 . . . . 0.0 110.574 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -52.04 -47.78 64.88 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.508 1.049 . . . . 0.0 113.328 174.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -63.13 -49.16 75.47 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.286 1.034 . . . . 0.0 111.79 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.703 HD13 ' HE1' ' A' ' 43' ' ' TRP . 4.0 mm? -58.75 -48.93 79.52 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.975 0.91 . . . . 0.0 110.433 176.04 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.439 ' HA ' ' HB ' ' A' ' 44' ' ' VAL . 31.7 m-20 -58.54 -35.29 72.09 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 125.008 1.323 . . . . 0.0 114.297 176.424 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.15 -53.49 57.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.553 0.615 . . . . 0.0 112.437 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.703 ' HE1' HD13 ' A' ' 40' ' ' LEU . 12.0 p-90 -73.29 -29.75 62.93 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 113.18 0.808 . . . . 0.0 113.18 175.299 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.703 HG22 HD12 ' A' ' 47' ' ' LEU . 1.6 t -60.22 -33.51 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.301 1.84 . . . . 0.0 113.588 172.362 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -56.71 -15.24 4.19 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 119.115 0.87 . . . . 0.0 112.818 173.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.18 -6.7 16.28 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.587 1.555 . . . . 0.0 114.147 176.25 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.703 HD12 HG22 ' A' ' 44' ' ' VAL . 13.6 mt . . . . . 0 N--CA 1.478 0.934 0 CA-C-N 119.671 1.123 . . . . 0.0 113.415 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 . . . . . 0 N--CA 1.475 0.805 0 CA-C-O 120.98 0.419 . . . . 0.0 112.066 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -61.97 -52.8 62.55 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.878 1.271 . . . . 0.0 112.335 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -54.74 -34.65 62.78 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.819 -0.61 . . . . 0.0 112.505 174.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.71 -51.96 24.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.97 0.805 . . . . 0.0 111.933 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -58.84 -47.45 84.81 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.37 0.668 . . . . 0.0 111.482 177.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -60.73 -50.95 71.4 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.739 1.216 . . . . 0.0 112.08 176.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.79 -49.61 74.83 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.773 1.169 . . . . 0.0 112.915 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -62.37 -50.67 70.65 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.878 0.871 . . . . 0.0 112.201 178.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tp -56.04 -50.3 71.33 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.662 0.785 . . . . 0.0 111.156 175.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.88 -45.75 85.9 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.347 1.059 . . . . 0.0 111.915 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.5 tptt -57.48 -48.42 79.25 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.564 1.075 . . . . 0.0 112.425 176.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.84 78.44 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.455 0.702 . . . . 0.0 112.254 176.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.418 ' O ' HG23 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -58.39 -50.0 75.25 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.737 1.215 . . . . 0.0 110.878 178.544 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -51.96 -49.47 63.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 126.382 1.873 . . . . 0.0 112.401 172.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -56.18 -49.08 75.02 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.687 0.795 . . . . 0.0 111.97 178.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.9 -33.41 75.53 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 174.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 73' ' ' HIS . 56.0 t -69.51 -27.54 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.814 1.246 . . . . 0.0 112.679 178.469 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.16 -28.73 42.19 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 175.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -98.63 -1.76 40.07 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.973 1.709 . . . . 0.0 114.463 175.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -90.24 -84.68 0.23 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.421 1.088 . . . . 0.0 111.251 175.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -129.97 154.21 81.14 Favored Pre-proline 0 N--CA 1.479 1.02 0 C-N-CA 126.508 1.923 . . . . 0.0 112.991 -173.488 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -69.93 -48.31 0.71 Allowed 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 123.683 2.922 . . . . 0.0 112.611 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -72.66 -33.72 66.75 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.88 -41.55 82.77 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 119.024 -0.513 . . . . 0.0 110.323 174.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.66 -48.98 74.13 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 117.87 -1.062 . . . . 0.0 110.302 173.338 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -56.38 -54.03 50.36 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.22 0.918 . . . . 0.0 110.736 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.08 -50.82 72.62 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.364 -0.835 . . . . 0.0 113.247 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -67.46 -44.16 79.3 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.815 0.846 . . . . 0.0 112.589 -177.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.86 93.77 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.441 1.097 . . . . 0.0 111.912 173.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.401 ' OE1' ' HE3' ' A' ' 93' ' ' LYS . 0.5 OUTLIER -59.99 -44.02 94.79 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.163 0.585 . . . . 0.0 111.73 174.367 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.442 ' HA ' HG22 ' A' ' 94' ' ' ILE . 1.8 mm? -63.47 -35.05 79.17 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 172.376 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.3 t -69.6 -47.24 64.17 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.43 1.092 . . . . 0.0 112.485 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.401 ' HE3' ' OE1' ' A' ' 90' ' ' GLU . 1.6 ptpm? -67.95 -41.58 82.25 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.615 0.766 . . . . 0.0 111.157 177.072 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.442 HG22 ' HA ' ' A' ' 91' ' ' LEU . 7.2 tt -71.07 -32.91 49.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 118.986 0.812 . . . . 0.0 112.6 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.64 -30.36 68.67 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.697 0 C-N-CA 124.755 1.222 . . . . 0.0 113.69 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.41 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.478 0.927 0 CA-C-O 121.432 0.634 . . . . 0.0 112.578 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -31.5 4.42 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.344 1.458 . . . . 0.0 114.078 173.123 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -62.15 -59.81 4.52 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.115 171.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.41 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -62.33 -35.13 78.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.394 0.997 . . . . 0.0 112.269 -177.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -59.11 -49.45 77.84 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.616 0.766 . . . . 0.0 112.416 172.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.59 -51.84 67.12 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 117.786 -1.102 . . . . 0.0 110.993 172.394 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 31.3 mm -49.72 -49.91 19.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.619 1.168 . . . . 0.0 111.355 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -62.09 -52.18 64.93 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.693 0.679 . . . . 0.0 111.856 176.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.1 -33.77 71.23 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.9 pt -79.33 -39.76 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 118.161 -0.923 . . . . 0.0 112.069 169.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 93.7 t80 . . . . . 0 N--CA 1.475 0.809 0 CA-C-N 121.308 1.867 . . . . 0.0 113.837 179.401 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo . . . . . 0 CA--C 1.539 0.752 0 CA-C-O 122.243 0.851 . . . . 0.0 112.734 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -59.16 -26.87 65.13 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 173.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 23.5 p -65.59 -50.08 66.41 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 120.027 1.285 . . . . 0.0 112.833 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.4 p -69.06 -39.3 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.42 0.688 . . . . 0.0 111.551 175.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 10.0 mtpt -59.13 -47.05 86.69 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 118.254 -0.879 . . . . 0.0 112.372 171.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -65.98 -41.28 91.35 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 119.971 1.26 . . . . 0.0 112.786 177.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.08 -37.06 80.8 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.986 -1.072 . . . . 0.0 112.835 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.44 -19.13 31.77 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.474 1.109 . . . . 0.0 113.309 178.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 . . . . . 0 N--CA 1.478 0.958 0 C-N-CA 126.492 1.917 . . . . 0.0 113.922 179.729 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo . . . . . 0 CA--C 1.542 0.909 0 CA-C-O 119.338 -0.359 . . . . 0.0 111.578 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -67.21 -26.01 42.56 Favored 'Trans proline' 0 CA--C 1.55 1.321 0 C-N-CA 122.367 2.045 . . . . 0.0 115.928 167.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.66 162.9 39.13 Favored 'Trans proline' 0 C--N 1.362 1.245 0 CA-C-N 123.954 2.448 . . . . 0.0 112.834 177.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -62.12 140.72 85.46 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.066 2.51 . . . . 0.0 111.827 171.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -52.32 -42.09 63.55 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.634 0.73 . . . . 0.0 112.221 171.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.542 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.7 pt? -84.76 19.22 2.11 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.604 1.962 . . . . 0.0 114.873 179.287 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -34.49 101.5 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.411 2.285 . . . . 0.0 115.548 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.64 29.1 0.14 Allowed Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.058 0.837 . . . . 0.0 114.498 -171.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.04 156.93 59.17 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 125.264 1.426 . . . . 0.0 111.692 -176.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -73.01 169.5 22.05 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.3 2.666 . . . . 0.0 112.777 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -54.12 -38.89 65.92 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.455 1.102 . . . . 0.0 113.423 -177.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.88 -39.24 68.5 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.523 1.529 . . . . 0.0 112.65 174.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.4 t -81.49 -39.63 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 124.899 1.28 . . . . 0.0 111.662 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 49.1 t -55.22 -40.95 58.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.881 0.872 . . . . 0.0 110.847 176.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -60.45 -50.66 72.68 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.929 -1.107 . . . . 0.0 112.378 175.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.24 -48.0 77.36 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.822 0.849 . . . . 0.0 111.855 177.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -50.73 59.46 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.094 0.958 . . . . 0.0 112.025 169.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.51 -47.38 86.4 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.968 0.804 . . . . 0.0 112.362 -177.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -66.48 -32.37 73.69 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.321 0.648 . . . . 0.0 112.096 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.6 tp -66.53 -49.08 67.67 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.563 0.745 . . . . 0.0 112.109 169.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.25 -25.13 68.18 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.526 1.53 . . . . 0.0 114.496 177.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -53.17 -33.11 51.16 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 119.888 1.222 . . . . 0.0 113.734 173.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.47 -38.81 65.31 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.296 1.038 . . . . 0.0 112.955 169.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -97.49 19.44 13.36 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.02 1.328 . . . . 0.0 113.096 -175.008 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.06 -19.83 63.33 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.323 -1.486 . . . . 0.0 114.395 -176.515 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.28 8.02 21.3 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 126.322 1.849 . . . . 0.0 113.002 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.5 mptt -75.8 178.97 5.76 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 120.638 -1.289 . . . . 0.0 111.658 176.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.09 171.27 7.47 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.441 1.897 . . . . 0.0 111.011 176.272 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -45.97 -59.08 5.19 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.825 1.65 . . . . 0.0 112.785 174.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.42 -38.57 19.46 Favored 'Trans proline' 0 C--N 1.357 1.016 0 C-N-CA 122.312 2.008 . . . . 0.0 112.613 178.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.26 -41.87 97.66 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.121 -0.987 . . . . 0.0 112.117 -177.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 12.1 mt -69.43 -51.45 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.103 0.961 . . . . 0.0 110.213 171.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -51.0 -38.08 49.03 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.05 0.841 . . . . 0.0 112.502 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.01 -60.3 3.64 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.383 1.473 . . . . 0.0 111.643 -179.081 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -64.08 -37.4 87.3 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.216 0.606 . . . . 0.0 112.19 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.719 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.1 mm? -64.68 -50.61 66.36 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.641 0.776 . . . . 0.0 110.93 174.273 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -56.85 -37.97 72.04 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 118.949 0.795 . . . . 0.0 113.014 176.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.07 -50.8 65.95 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -178.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.719 ' HE1' HD13 ' A' ' 40' ' ' LEU . 9.4 p-90 -73.53 -36.38 65.69 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 170.39 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.419 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.7 OUTLIER -56.89 -32.88 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.086 1.354 . . . . 0.0 112.118 175.977 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -59.73 -16.39 26.99 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.663 0.785 . . . . 0.0 112.538 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.8 m -102.01 -15.9 16.64 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.172 1.389 . . . . 0.0 112.607 177.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.638 HD11 ' CH2' ' A' ' 43' ' ' TRP . 15.2 mt . . . . . 0 N--CA 1.473 0.703 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 177.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.4 -52.36 58.6 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.572 1.549 . . . . 0.0 113.141 176.638 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -55.07 -34.83 63.94 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 118.585 -0.722 . . . . 0.0 112.143 173.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.27 -51.61 29.2 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.067 0.849 . . . . 0.0 111.778 178.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -58.62 -49.32 77.91 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.899 0.879 . . . . 0.0 111.469 176.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -64.3 -50.03 69.45 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.609 1.163 . . . . 0.0 112.2 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.03 -44.48 91.75 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.177 0.898 . . . . 0.0 111.87 176.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -65.07 -50.42 66.23 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.465 0.706 . . . . 0.0 111.882 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -53.72 -51.2 64.06 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.438 1.095 . . . . 0.0 110.557 172.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.05 -41.04 95.84 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.802 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.86 -50.65 72.96 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.338 1.055 . . . . 0.0 111.999 176.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.42 -47.76 84.28 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.754 0.822 . . . . 0.0 112.635 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -59.68 -51.14 71.06 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.944 0.897 . . . . 0.0 110.687 177.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -46.71 68.14 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.401 1.88 . . . . 0.0 112.968 174.537 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -54.79 -52.57 62.21 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.187 0.995 . . . . 0.0 112.388 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.99 -30.45 69.71 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 177.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 73.8 t -72.97 -22.57 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.808 1.643 . . . . 0.0 113.153 176.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.65 -30.53 63.44 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 176.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -87.53 0.17 55.96 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.295 1.438 . . . . 0.0 114.554 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.9 tpp -97.09 -162.12 0.93 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.193 1.797 . . . . 0.0 111.844 -177.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -53.41 154.85 5.7 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 126.768 2.027 . . . . 0.0 113.546 171.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -70.13 -43.99 2.06 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.389 2.726 . . . . 0.0 112.41 -177.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -62.45 -28.09 69.57 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.018 0.927 . . . . 0.0 113.26 176.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.33 -48.61 79.05 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.877 -0.514 . . . . 0.0 110.981 177.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.34 -41.26 60.45 Favored 'General case' 0 N--CA 1.482 1.158 0 O-C-N 121.492 -0.755 . . . . 0.0 111.678 173.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.413 ' HB3' ' HB1' ' A' ' 106' ' ' ALA . 66.0 mmtt -61.75 -50.32 72.87 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.484 1.514 . . . . 0.0 111.433 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.93 -46.09 89.43 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-O 121.938 0.875 . . . . 0.0 113.079 177.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -65.75 -41.12 92.5 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 120.729 -1.232 . . . . 0.0 112.369 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.62 -38.89 89.28 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 117.826 -1.083 . . . . 0.0 112.277 171.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.61 ' HB2' HD13 ' A' ' 103' ' ' ILE . 6.6 tm-20 -55.24 -53.36 56.99 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.355 1.434 . . . . 0.0 111.593 170.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.14 -36.2 83.26 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-O 121.159 0.504 . . . . 0.0 112.061 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.5 t -73.49 -40.64 63.94 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.188 -0.945 . . . . 0.0 112.403 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.68 -49.48 58.65 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 117.901 -1.047 . . . . 0.0 109.433 174.385 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.1 tp -66.48 -29.66 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 119.873 1.215 . . . . 0.0 113.241 -175.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.15 -17.11 62.56 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 173.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 CA--C 1.545 0.771 0 C-N-CA 125.852 1.661 . . . . 0.0 113.146 -178.26 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.61 HD13 ' HB2' ' A' ' 90' ' ' GLU . 1.8 tp . . . . . 0 N--CA 1.471 0.594 0 CA-C-O 118.678 -0.677 . . . . 0.0 112.184 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -43.48 -45.9 6.63 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -55.96 -59.4 4.96 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.876 1.27 . . . . 0.0 111.237 171.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.413 ' HB1' ' HB3' ' A' ' 86' ' ' LYS . . . -57.09 -38.28 73.11 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.177 0.991 . . . . 0.0 113.411 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.33 -49.16 78.71 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 126.327 1.851 . . . . 0.0 111.031 174.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.5 mttm -54.69 -48.2 72.72 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.046 -0.978 . . . . 0.0 111.6 173.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.6 mm -56.67 -48.66 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 CA-C-N 119.026 0.83 . . . . 0.0 111.462 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -58.73 -47.52 84.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.188 0.449 . . . . 0.0 111.579 177.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.81 -49.03 79.11 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.153 1.381 . . . . 0.0 112.075 -176.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.8 pt -68.81 -29.56 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 121.385 -0.822 . . . . 0.0 111.909 173.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.5 t80 . . . . . 0 CA--C 1.541 0.61 0 CA-C-N 119.529 1.059 . . . . 0.0 113.495 176.507 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo . . . . . 0 N--CA 1.459 -0.531 0 CA-C-O 121.704 0.627 . . . . 0.0 111.737 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 29.2 tp60 -63.58 -23.7 67.5 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.367 -0.833 . . . . 0.0 112.219 177.41 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.1 t -61.86 -51.52 67.88 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.2 1.4 . . . . 0.0 112.184 178.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.9 p -69.06 -37.02 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 O-C-N 121.72 -0.612 . . . . 0.0 111.561 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -60.22 -47.89 84.07 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.917 173.066 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -68.3 -39.66 81.98 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.458 1.027 . . . . 0.0 112.928 177.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.61 -37.09 82.03 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.097 -1.002 . . . . 0.0 112.246 177.194 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.89 -20.13 29.51 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.309 1.044 . . . . 0.0 113.571 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.919 0 C-N-CA 126.001 1.72 . . . . 0.0 112.574 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo . . . . . 0 CA--C 1.544 0.998 0 CA-C-O 119.083 -0.465 . . . . 0.0 111.419 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -71.95 -20.47 25.6 Favored 'Trans proline' 0 CA--C 1.55 1.28 0 CA-C-O 115.652 -1.895 . . . . 0.0 116.121 167.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.36 166.5 29.1 Favored 'Trans proline' 0 C--N 1.363 1.303 0 CA-C-N 124.427 2.617 . . . . 0.0 112.219 176.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -59.16 132.37 46.58 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.859 2.372 . . . . 0.0 111.361 169.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -49.82 -46.47 51.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.273 0.629 . . . . 0.0 110.848 169.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.727 HD13 ' H ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -93.4 35.44 1.1 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.93 2.492 . . . . 0.0 113.785 -179.606 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.12 110.75 0.19 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.497 1.519 . . . . 0.0 113.864 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.46 18.08 0.28 Allowed Glycine 0 CA--C 1.539 1.588 0 C-N-CA 125.453 1.501 . . . . 0.0 115.717 -174.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.4 160.84 38.09 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 125.857 1.663 . . . . 0.0 112.667 -170.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.09 170.35 20.58 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.504 2.803 . . . . 0.0 113.298 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -53.75 -35.24 61.02 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -179.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.49 -40.53 65.44 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.325 1.45 . . . . 0.0 112.692 173.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.5 t -81.45 -45.27 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 C-N-CA 125.398 1.479 . . . . 0.0 112.203 174.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 92.8 t -54.64 -38.6 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 123.573 0.749 . . . . 0.0 111.07 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -63.35 -50.6 69.35 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.202 -0.936 . . . . 0.0 112.084 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.41 -48.65 71.37 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.018 0.827 . . . . 0.0 112.356 176.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.11 -53.69 39.47 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.719 1.208 . . . . 0.0 111.597 171.146 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -62.96 -47.52 82.82 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -59.33 -41.36 88.96 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.583 1.153 . . . . 0.0 110.888 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 tp -60.91 -52.01 66.84 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 122.575 0.35 . . . . 0.0 111.306 169.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.45 -33.78 68.3 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 178.206 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -55.14 -35.16 64.43 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 120.449 1.477 . . . . 0.0 113.319 177.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -72.81 -25.26 61.08 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.993 1.317 . . . . 0.0 113.277 172.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -109.83 14.11 23.31 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 126.216 1.806 . . . . 0.0 113.488 -174.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -21.05 60.18 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.289 -1.507 . . . . 0.0 113.814 -171.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.6 p -109.22 2.47 20.95 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.474 2.31 . . . . 0.0 114.316 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -76.56 170.81 15.72 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.064 1.745 . . . . 0.0 111.906 176.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.404 HG22 ' H ' ' A' ' 33' ' ' ASP . 0.2 OUTLIER -84.51 172.02 12.02 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.768 1.227 . . . . 0.0 112.307 173.7 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.404 ' H ' HG22 ' A' ' 32' ' ' THR . 21.6 t0 -49.45 -63.5 1.66 Allowed Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 127.294 2.238 . . . . 0.0 112.302 173.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -62.21 -32.47 82.57 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 122.755 2.303 . . . . 0.0 113.328 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -64.65 -51.16 64.04 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.679 0.792 . . . . 0.0 111.885 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 50.8 mt -64.74 -52.52 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 124.291 1.036 . . . . 0.0 110.028 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -47.7 -52.05 19.69 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.25 1.82 . . . . 0.0 112.706 178.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -57.71 -44.29 85.8 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.306 0.957 . . . . 0.0 112.702 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.67 -43.29 97.13 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.191 0.997 . . . . 0.0 112.67 174.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.74 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.7 mm? -58.72 -48.98 79.28 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.19 1.396 . . . . 0.0 111.75 173.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -62.95 -37.66 87.96 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 177.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.3 -48.87 73.47 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.74 ' HE1' HD13 ' A' ' 40' ' ' LEU . 7.2 p-90 -73.88 -34.0 64.26 Favored 'General case' 0 CA--C 1.553 1.078 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 173.154 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.46 HG23 HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -57.82 -32.46 43.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 124.724 1.21 . . . . 0.0 112.485 173.935 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.39 -15.78 29.4 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 118.677 0.671 . . . . 0.0 112.733 177.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 42.2 m -94.57 -21.44 18.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.947 1.299 . . . . 0.0 113.057 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.577 HD11 ' CH2' ' A' ' 43' ' ' TRP . 24.9 mt . . . . . 0 N--CA 1.477 0.905 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 . . . . . 0 N--CA 1.471 0.613 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 13.2 mmt -73.84 -45.14 52.98 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.97 -35.24 70.91 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.373 0.533 . . . . 0.0 112.011 173.303 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.65 -50.59 35.12 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.754 1.222 . . . . 0.0 111.263 176.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.8 tptt -55.74 -53.26 58.8 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.783 0.719 . . . . 0.0 110.351 177.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -60.04 -51.73 68.41 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.923 1.289 . . . . 0.0 111.991 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.16 -45.8 93.15 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.599 1.09 . . . . 0.0 113.081 177.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -65.64 -46.65 78.42 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.731 0.813 . . . . 0.0 111.721 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 48.7 mt -57.69 -51.13 70.8 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.365 1.066 . . . . 0.0 111.014 172.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.52 88.62 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.705 0.802 . . . . 0.0 112.142 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -59.43 -50.92 72.08 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.329 1.052 . . . . 0.0 112.277 176.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.91 -47.88 84.37 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.835 0.854 . . . . 0.0 112.775 176.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -55.98 -54.21 47.61 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.844 0.858 . . . . 0.0 111.367 173.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.35 -42.27 77.49 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 119.75 1.159 . . . . 0.0 112.781 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -52.49 64.23 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.416 1.086 . . . . 0.0 112.559 171.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.91 -30.72 70.95 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 176.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 52.9 t -73.09 -25.06 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 126.407 1.883 . . . . 0.0 113.003 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.91 -30.86 66.24 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 177.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.7 pttt -86.68 0.2 55.04 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.168 1.387 . . . . 0.0 114.277 173.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.7 ttm -102.3 -160.3 0.78 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.67 1.988 . . . . 0.0 111.822 -173.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.18 156.12 22.47 Favored Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 125.391 1.476 . . . . 0.0 113.757 177.69 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.06 -46.19 1.62 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.415 2.743 . . . . 0.0 112.858 -176.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.71 -32.22 70.32 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.153 0.981 . . . . 0.0 112.463 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.72 -49.0 72.56 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.231 0.613 . . . . 0.0 109.96 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -54.33 -43.47 71.25 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 118.564 -0.731 . . . . 0.0 111.464 173.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -59.25 -54.71 43.76 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.255 0.934 . . . . 0.0 110.871 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.77 -49.01 79.24 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 177.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -70.37 -35.79 73.74 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.93 -44.71 88.6 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.906 1.23 . . . . 0.0 111.24 172.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -44.66 82.55 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.824 0.85 . . . . 0.0 111.883 172.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.73 -36.49 83.75 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 121.504 -0.748 . . . . 0.0 112.721 173.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.1 t -72.22 -37.63 69.16 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.786 -1.196 . . . . 0.0 112.644 -177.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -71.08 -51.4 25.4 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 118.911 -0.566 . . . . 0.0 110.032 173.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.5 tt -63.41 -29.77 48.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-N 119.111 0.869 . . . . 0.0 112.881 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.43 -24.2 63.3 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 177.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 N--CA 1.475 0.785 0 C-N-CA 124.473 1.109 . . . . 0.0 113.758 170.912 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.473 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -47.49 -36.7 10.58 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.56 1.144 . . . . 0.0 113.283 171.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.9 mttt -60.47 -59.42 5.43 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.028 0.831 . . . . 0.0 111.238 173.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.473 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.55 -37.44 87.55 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.036 0.835 . . . . 0.0 111.942 -175.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.6 tm0? -53.27 -51.66 61.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.2 1.0 . . . . 0.0 110.892 171.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -59.51 -49.22 78.62 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 118.05 -0.976 . . . . 0.0 112.57 176.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 33.9 mm -50.74 -48.57 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.64 1.176 . . . . 0.0 110.947 174.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -66.8 -43.26 84.32 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 121.286 -0.884 . . . . 0.0 112.194 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.51 -42.52 92.43 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.524 1.129 . . . . 0.0 112.636 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.7 pp -74.86 -40.12 45.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 121.685 -0.634 . . . . 0.0 111.861 172.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 67.2 t80 . . . . . 0 N--CA 1.474 0.729 0 C-N-CA 124.731 1.213 . . . . 0.0 113.427 179.873 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 CA--C 1.535 0.548 0 CA-C-O 121.679 0.616 . . . . 0.0 112.584 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -59.22 -22.09 60.52 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 11.2 t -64.17 -51.7 62.56 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.538 1.063 . . . . 0.0 111.793 174.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.9 p -73.88 -38.01 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 O-C-N 121.7 -0.625 . . . . 0.0 111.502 178.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 mmmt -58.11 -49.5 76.73 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 118.521 -0.752 . . . . 0.0 111.896 172.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -68.2 -39.3 82.48 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.701 1.137 . . . . 0.0 113.388 178.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -67.23 -34.72 78.06 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.474 1.034 . . . . 0.0 112.641 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.51 -21.4 26.98 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.095 0.958 . . . . 0.0 113.148 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 C-N-CA 125.392 1.477 . . . . 0.0 113.909 177.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo . . . . . 0 CA--C 1.544 0.998 0 CA-C-O 119.189 -0.421 . . . . 0.0 111.491 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -70.32 -22.53 29.39 Favored 'Trans proline' 0 CA--C 1.552 1.402 0 CA-C-O 115.727 -1.864 . . . . 0.0 115.817 163.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.93 169.32 19.4 Favored 'Trans proline' 0 C--N 1.363 1.309 0 CA-C-N 124.222 2.544 . . . . 0.0 112.484 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -59.86 129.3 29.95 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.398 2.065 . . . . 0.0 110.357 171.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -47.67 -47.86 29.29 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.141 0.576 . . . . 0.0 110.964 170.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.755 HD13 ' H ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -91.56 38.77 0.99 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 128.997 2.919 . . . . 0.0 114.242 177.293 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.5 112.69 0.41 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.511 1.125 . . . . 0.0 113.609 174.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 143.65 -12.86 2.21 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.958 1.742 . . . . 0.0 114.616 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.31 161.29 75.45 Favored Pre-proline 0 CA--C 1.558 1.281 0 C-N-CA 125.342 1.457 . . . . 0.0 113.706 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -75.7 172.72 15.77 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.913 3.075 . . . . 0.0 113.675 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -53.31 -37.76 62.56 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.851 1.261 . . . . 0.0 113.821 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -53.24 -41.14 65.14 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.024 1.33 . . . . 0.0 112.696 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.6 t -80.47 -42.23 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 124.599 1.16 . . . . 0.0 111.983 174.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -54.81 -39.31 47.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-N 118.593 0.633 . . . . 0.0 110.688 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.3 tptm -61.16 -50.65 72.29 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.079 -1.013 . . . . 0.0 112.137 174.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.6 -50.4 68.15 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.177 0.591 . . . . 0.0 111.816 176.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.44 -50.58 59.47 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.807 0.843 . . . . 0.0 111.9 170.605 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.15 -47.45 85.86 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.285 0.948 . . . . 0.0 112.819 -176.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -70.96 -32.28 69.1 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.949 -0.47 . . . . 0.0 111.899 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.3 tp -64.35 -49.15 72.81 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.775 0.83 . . . . 0.0 111.516 170.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -66.53 -29.51 69.62 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.926 1.29 . . . . 0.0 114.448 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.6 mttm -54.7 -51.84 64.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 120.062 1.301 . . . . 0.0 112.833 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.95 -17.93 64.59 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.561 1.144 . . . . 0.0 113.687 173.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -108.79 18.65 20.55 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.543 1.937 . . . . 0.0 113.693 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.09 -20.46 65.98 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 120.18 -1.575 . . . . 0.0 113.512 -176.441 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -103.51 6.76 37.65 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 126.859 2.064 . . . . 0.0 112.991 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -73.73 -172.55 1.28 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.503 1.521 . . . . 0.0 112.704 173.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 m -123.48 170.44 10.38 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 128.098 2.559 . . . . 0.0 110.453 -178.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.7 -56.78 7.89 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.849 1.659 . . . . 0.0 112.637 175.398 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -68.82 -41.99 5.03 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.212 1.941 . . . . 0.0 113.072 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.53 -41.56 94.68 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.379 -1.451 . . . . 0.0 112.654 -178.218 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 64.3 mt -69.46 -53.43 24.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 123.588 0.755 . . . . 0.0 109.641 174.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -58.63 -35.39 72.42 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.037 0.835 . . . . 0.0 111.662 -174.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -54.31 -60.9 2.72 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.337 1.455 . . . . 0.0 112.579 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.6 -36.88 85.26 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.074 0.549 . . . . 0.0 112.078 -178.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.594 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.4 mm? -63.06 -48.97 76.39 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.437 1.095 . . . . 0.0 111.574 174.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -65.23 -34.13 77.63 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 121.568 -0.708 . . . . 0.0 112.363 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.22 -50.87 66.12 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.454 -0.779 . . . . 0.0 112.574 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.594 ' HE1' HD13 ' A' ' 40' ' ' LEU . 7.8 p-90 -73.88 -31.33 63.08 Favored 'General case' 0 CA--C 1.557 1.249 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 170.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.499 HG23 HD12 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -59.46 -32.48 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 O-C-N 120.243 -1.536 . . . . 0.0 111.813 174.136 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -59.2 -18.62 38.23 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.583 -0.698 . . . . 0.0 112.366 176.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -97.61 -13.59 21.48 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.861 1.264 . . . . 0.0 113.237 177.005 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.549 HD11 ' CH2' ' A' ' 43' ' ' TRP . 22.0 mt . . . . . 0 N--CA 1.474 0.771 0 CA-C-N 119.048 0.84 . . . . 0.0 112.667 174.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.02 -48.53 73.58 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.383 1.073 . . . . 0.0 112.075 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -54.73 -39.99 68.8 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.517 0.727 . . . . 0.0 111.556 172.114 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.25 -51.17 56.34 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.798 0.726 . . . . 0.0 111.454 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -60.35 -48.16 82.96 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.73 0.812 . . . . 0.0 111.027 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -61.24 -49.83 75.53 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.067 1.347 . . . . 0.0 112.089 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.82 -51.63 68.22 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.788 1.176 . . . . 0.0 112.86 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -62.78 -48.36 79.49 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.811 -0.556 . . . . 0.0 112.465 178.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.1 tp -54.46 -51.24 65.63 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.184 0.994 . . . . 0.0 110.955 174.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.78 -42.92 99.61 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.581 1.152 . . . . 0.0 112.072 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -58.17 -50.84 72.11 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.824 1.193 . . . . 0.0 111.466 174.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.34 -47.86 80.42 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.762 0.825 . . . . 0.0 112.713 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -54.5 -56.29 20.37 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.209 1.004 . . . . 0.0 111.068 172.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.82 -40.81 73.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.519 1.128 . . . . 0.0 113.205 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.51 -52.54 65.2 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 171.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.19 -29.76 70.09 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 176.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.6 t -73.13 -26.66 23.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 125.868 1.667 . . . . 0.0 112.678 175.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.56 -34.32 64.64 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.5 pttt -85.03 1.71 46.46 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.286 1.435 . . . . 0.0 114.347 175.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.7 ttm -103.25 -159.27 0.71 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.985 2.114 . . . . 0.0 111.695 -174.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.74 156.71 11.81 Favored Pre-proline 0 N--CA 1.479 1.003 0 C-N-CA 125.283 1.433 . . . . 0.0 113.864 176.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.43 -45.54 1.73 Allowed 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.448 2.765 . . . . 0.0 112.803 -177.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -61.3 -30.71 70.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.147 0.979 . . . . 0.0 112.438 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.76 -48.44 71.82 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.837 0.455 . . . . 0.0 110.23 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.19 -44.62 68.07 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.385 173.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm -59.53 -54.77 42.68 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.034 0.833 . . . . 0.0 110.863 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.08 -49.14 78.81 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.698 -0.626 . . . . 0.0 112.481 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -66.55 -32.94 74.61 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.05 -46.57 80.68 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.663 1.119 . . . . 0.0 111.577 172.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -56.91 -47.06 81.45 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 118.891 0.769 . . . . 0.0 111.662 172.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.6 tp -63.06 -38.75 92.44 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 176.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 21.7 t -71.13 -42.97 68.52 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.69 -1.256 . . . . 0.0 112.256 -178.007 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.38 -46.11 70.92 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 118.666 -0.683 . . . . 0.0 110.624 175.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.3 tp -66.47 -33.72 65.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 119.263 0.938 . . . . 0.0 111.717 -178.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.04 -32.77 74.45 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 . . . . . 0 N--CA 1.471 0.577 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 173.234 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.411 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -46.93 -37.72 9.41 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.873 1.269 . . . . 0.0 113.429 -178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -61.1 -59.42 5.37 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.864 0.866 . . . . 0.0 110.947 172.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.411 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -63.81 -33.63 76.1 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.794 0.724 . . . . 0.0 112.285 -177.114 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.07 -50.99 71.96 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.83 1.252 . . . . 0.0 111.426 173.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.9 -48.47 79.79 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.111 0.964 . . . . 0.0 111.03 173.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 18.4 mm -53.31 -50.59 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 124.378 1.071 . . . . 0.0 111.322 176.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -63.13 -44.44 95.56 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.779 1.172 . . . . 0.0 112.887 176.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.81 -49.0 78.1 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.077 0.951 . . . . 0.0 110.784 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.4 pt -70.49 -38.86 75.2 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 CA-C-O 118.243 -0.884 . . . . 0.0 112.629 173.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 81.6 t80 . . . . . 0 N--CA 1.475 0.783 0 CA-C-N 121.006 1.73 . . . . 0.0 113.075 -178.62 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo . . . . . 0 CA--C 1.537 0.63 0 CA-C-O 121.743 0.643 . . . . 0.0 111.904 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -60.53 -27.33 67.54 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.401 -0.812 . . . . 0.0 113.036 173.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 65.6 m -60.46 -51.71 68.32 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.435 1.471 . . . . 0.0 112.381 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.461 HG22 HD23 ' A' ' 124' ' ' LEU . 14.8 p -68.56 -40.15 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.811 -0.556 . . . . 0.0 111.638 175.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 mmtt -58.16 -48.1 81.33 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.502 174.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -69.05 -38.17 78.95 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.674 1.125 . . . . 0.0 113.444 177.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -69.29 -37.09 77.66 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.605 1.093 . . . . 0.0 112.326 177.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.461 HD23 HG22 ' A' ' 120' ' ' VAL . 0.5 OUTLIER -85.83 -20.82 28.57 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.682 1.193 . . . . 0.0 113.132 179.413 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.11 0 C-N-CA 126.605 1.962 . . . . 0.0 113.601 177.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo . . . . . 0 CA--C 1.546 1.081 0 N-CA-C 111.079 -0.393 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -69.47 -22.8 32.89 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 CA-C-O 115.381 -2.008 . . . . 0.0 115.995 164.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.89 169.9 20.13 Favored 'Trans proline' 0 C--N 1.363 1.333 0 CA-C-N 124.487 2.638 . . . . 0.0 113.451 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -62.21 121.24 9.17 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.18 2.586 . . . . 0.0 111.975 175.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -56.72 -19.14 15.17 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 171.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.401 ' N ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -117.29 36.69 4.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 129.317 3.047 . . . . 0.0 112.415 178.128 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.16 110.89 0.24 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.401 1.48 . . . . 0.0 113.007 175.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.17 13.11 0.2 Allowed Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.916 1.246 . . . . 0.0 115.766 -174.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -116.76 160.02 38.28 Favored Pre-proline 0 CA--C 1.554 1.114 0 C-N-CA 125.663 1.585 . . . . 0.0 112.67 -170.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -73.82 171.4 17.94 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.423 2.749 . . . . 0.0 113.299 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -55.35 -34.01 63.9 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -53.3 -40.71 64.96 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.249 1.42 . . . . 0.0 112.779 171.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 56.0 t -78.75 -44.18 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 124.508 1.123 . . . . 0.0 111.986 173.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 73.7 t -53.91 -39.52 40.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-N 118.816 0.735 . . . . 0.0 111.211 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 tptm -62.78 -50.45 70.99 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.038 -1.038 . . . . 0.0 112.223 174.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.63 -49.24 71.0 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.258 0.623 . . . . 0.0 111.691 176.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.89 -51.19 58.56 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.29 1.036 . . . . 0.0 111.976 170.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.44 -47.3 86.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.881 1.218 . . . . 0.0 113.312 -177.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -65.7 -40.41 92.25 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.895 -0.503 . . . . 0.0 110.979 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.2 tp -61.66 -46.38 89.99 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.862 0.865 . . . . 0.0 111.524 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -63.16 -40.8 98.58 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.714 -1.241 . . . . 0.0 113.8 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.5 mmtp -56.06 -36.0 67.56 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 119.262 0.937 . . . . 0.0 112.974 174.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.68 -38.35 70.64 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.274 1.43 . . . . 0.0 113.497 173.369 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -98.3 20.39 12.65 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.538 1.535 . . . . 0.0 113.168 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -66.67 -17.08 64.66 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 119.813 -1.804 . . . . 0.0 113.923 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.0 p -95.35 2.01 54.51 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 127.312 2.245 . . . . 0.0 114.363 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -84.08 179.42 7.51 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.652 1.581 . . . . 0.0 111.163 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.44 170.8 7.73 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.673 1.989 . . . . 0.0 111.068 177.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -47.78 -58.35 7.89 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 124.987 1.315 . . . . 0.0 112.221 175.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.75 -36.85 17.57 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.044 1.829 . . . . 0.0 114.26 178.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.99 -45.08 96.25 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 120.959 -1.088 . . . . 0.0 111.918 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.8 mt -69.46 -48.53 66.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-O 118.665 -0.683 . . . . 0.0 110.552 175.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -52.31 -41.11 62.68 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.244 0.929 . . . . 0.0 111.249 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.64 -50.75 71.3 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.215 1.406 . . . . 0.0 112.63 177.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.09 -43.31 95.62 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.45 0.7 . . . . 0.0 112.278 176.58 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.705 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.3 mm? -63.26 -48.54 77.74 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.727 0.811 . . . . 0.0 110.525 175.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -60.41 -31.27 70.22 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 176.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.16 -51.75 68.67 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.437 -0.789 . . . . 0.0 112.072 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.705 ' HE1' HD13 ' A' ' 40' ' ' LEU . 15.8 p-90 -73.84 -31.22 63.1 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 112.986 0.735 . . . . 0.0 112.986 173.037 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.422 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -57.82 -32.89 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 125.6 1.56 . . . . 0.0 112.993 174.45 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -57.77 -15.75 9.1 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.24 -14.84 18.3 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.469 1.507 . . . . 0.0 113.549 176.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.661 HD11 ' CH2' ' A' ' 43' ' ' TRP . 23.4 mt . . . . . 0 N--CA 1.475 0.807 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 176.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -61.47 -53.39 57.04 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 121.522 -0.736 . . . . 0.0 112.437 177.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.8 mmtm -55.74 -35.55 66.29 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.2 1.0 . . . . 0.0 111.817 176.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.12 -51.02 42.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.071 0.948 . . . . 0.0 111.034 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.69 -46.4 89.19 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.694 0.798 . . . . 0.0 111.55 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -62.72 -51.71 66.13 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.675 1.19 . . . . 0.0 112.019 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.11 -46.03 86.23 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.039 0.836 . . . . 0.0 112.432 177.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -63.42 -46.67 85.26 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.038 0.935 . . . . 0.0 112.46 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -56.44 -50.97 70.12 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.223 1.009 . . . . 0.0 111.325 171.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.12 -40.47 89.82 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.248 0.619 . . . . 0.0 111.986 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -61.45 -50.23 73.6 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.764 1.226 . . . . 0.0 111.668 175.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.68 -47.05 85.81 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.542 0.61 . . . . 0.0 112.332 177.055 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.433 ' O ' HG23 ' A' ' 77' ' ' VAL . 0.7 OUTLIER -57.24 -53.56 56.71 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.922 0.889 . . . . 0.0 111.26 175.185 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -50.82 -45.69 59.63 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.3 1.44 . . . . 0.0 113.155 174.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.3 -50.87 72.09 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.944 1.298 . . . . 0.0 111.973 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.38 -34.14 77.6 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 172.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 73' ' ' HIS . 72.3 t -72.2 -23.46 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 124.927 1.291 . . . . 0.0 112.578 179.285 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.03 -31.25 60.95 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.68 -1.263 . . . . 0.0 114.382 175.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.93 -2.79 52.55 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.986 1.314 . . . . 0.0 114.298 176.054 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.21 -160.27 0.79 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.832 2.053 . . . . 0.0 112.036 -174.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -52.57 155.05 4.08 Favored Pre-proline 0 N--CA 1.479 0.985 0 C-N-CA 126.529 1.932 . . . . 0.0 113.485 171.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -67.05 -49.96 1.21 Allowed 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.296 2.664 . . . . 0.0 112.269 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -61.08 -27.76 68.59 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.967 1.307 . . . . 0.0 113.298 178.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.85 -51.96 62.24 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.913 0.485 . . . . 0.0 110.086 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.2 -42.3 66.15 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.265 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.2 mmtm -60.29 -54.73 42.2 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.564 0.62 . . . . 0.0 110.654 -178.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.38 84.04 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.424 0.689 . . . . 0.0 112.788 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.14 -40.51 86.76 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 177.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.96 -48.35 82.05 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.378 1.071 . . . . 0.0 111.074 171.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.63 -43.76 72.55 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.364 1.066 . . . . 0.0 112.057 173.035 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.455 ' HA ' HG22 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -68.79 -34.59 75.8 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 118.893 0.77 . . . . 0.0 112.866 176.332 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.9 t -71.96 -43.73 64.72 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.754 -1.216 . . . . 0.0 113.016 177.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -35.5 68.91 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.316 1.046 . . . . 0.0 111.705 176.233 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.455 HG22 ' HA ' ' A' ' 91' ' ' LEU . 5.6 tt -73.05 -32.73 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 119.253 0.933 . . . . 0.0 111.906 175.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.36 -16.66 37.27 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.546 0.797 0 C-N-CA 125.713 1.605 . . . . 0.0 113.566 175.132 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.478 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -47.63 -33.87 7.25 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.297 1.439 . . . . 0.0 113.272 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -59.38 -59.57 5.24 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.797 0.839 . . . . 0.0 111.053 171.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.478 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.09 -37.83 88.87 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.19 0.905 . . . . 0.0 111.849 -176.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -53.92 -52.02 61.9 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.67 0.788 . . . . 0.0 111.17 172.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.6 tttt -58.17 -51.78 68.31 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.683 175.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 25.5 mm -49.78 -46.92 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.438 1.095 . . . . 0.0 110.584 178.006 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -69.16 -42.54 75.78 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.635 0.774 . . . . 0.0 112.795 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.45 -31.99 71.96 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.229 1.412 . . . . 0.0 113.672 174.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 29.3 pt -87.32 -31.31 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 119.113 0.869 . . . . 0.0 112.596 171.663 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.413 ' OH ' HD11 ' A' ' 124' ' ' LEU . 66.2 t80 . . . . . 0 N--CA 1.466 0.335 0 O-C-N 120.843 -1.16 . . . . 0.0 111.911 176.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 CA--C 1.536 0.589 0 CA-C-O 121.545 0.56 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -60.35 -24.34 64.99 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 174.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.3 p -63.93 -51.32 64.96 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.691 1.132 . . . . 0.0 112.019 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.4 p -71.88 -39.31 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.853 -0.529 . . . . 0.0 111.576 176.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -56.71 -51.62 68.1 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 118.607 -0.711 . . . . 0.0 112.001 172.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -67.79 -42.38 81.74 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.578 1.081 . . . . 0.0 112.247 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.83 -35.85 81.28 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.115 -0.991 . . . . 0.0 112.546 176.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.413 HD11 ' OH ' ' A' ' 113' ' ' TYR . 0.5 OUTLIER -90.18 -19.41 24.25 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.113 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 . . . . . 0 N--CA 1.48 1.025 0 C-N-CA 126.106 1.762 . . . . 0.0 113.065 176.378 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo . . . . . 0 CA--C 1.544 0.984 0 CA-C-O 119.257 -0.393 . . . . 0.0 111.849 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.14 -21.66 26.93 Favored 'Trans proline' 0 CA--C 1.553 1.467 0 C-N-CA 122.591 2.194 . . . . 0.0 116.654 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.4 167.41 25.36 Favored 'Trans proline' 0 C--N 1.361 1.216 0 CA-C-N 124.241 2.55 . . . . 0.0 112.271 176.238 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.443 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 33.3 Cg_endo -58.27 133.33 54.43 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.803 2.335 . . . . 0.0 111.752 170.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -49.24 -48.68 45.47 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.397 0.679 . . . . 0.0 111.635 171.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.556 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.6 pt? -81.34 18.1 1.2 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 127.128 2.171 . . . . 0.0 115.03 -178.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.36 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.956 2.102 . . . . 0.0 115.467 -172.211 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.19 24.22 0.1 Allowed Glycine 0 CA--C 1.538 1.502 0 C-N-CA 124.979 1.276 . . . . 0.0 114.758 -173.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -121.76 157.74 56.31 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 125.856 1.662 . . . . 0.0 111.944 -173.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -73.99 169.14 23.11 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.182 2.588 . . . . 0.0 113.205 -177.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -52.09 -41.06 62.1 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.585 1.554 . . . . 0.0 113.275 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -54.22 -42.01 69.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.09 1.356 . . . . 0.0 112.91 173.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.5 t -78.9 -39.24 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.371 1.069 . . . . 0.0 111.503 176.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 46.9 t -57.04 -40.08 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.689 0.795 . . . . 0.0 111.098 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.9 tptt -63.02 -50.63 69.94 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.9 -1.125 . . . . 0.0 111.968 174.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -52.84 -48.42 67.02 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.501 0.72 . . . . 0.0 112.232 174.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.443 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 1.5 t80 -50.66 -53.66 29.24 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.593 1.157 . . . . 0.0 111.964 168.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.35 -47.48 85.86 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.324 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -62.11 -42.87 99.67 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.541 0.736 . . . . 0.0 111.166 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.4 tp -58.25 -47.7 82.75 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.522 0.729 . . . . 0.0 111.258 172.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -64.39 -30.75 71.79 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -57.89 -29.97 65.49 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 120.392 1.451 . . . . 0.0 113.279 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -46.34 68.59 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.613 1.165 . . . . 0.0 112.105 169.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -94.16 17.68 12.17 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.336 1.854 . . . . 0.0 114.046 -174.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.76 -25.03 66.2 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 120.044 -1.66 . . . . 0.0 113.316 -172.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.2 p -87.51 -0.48 56.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.555 1.942 . . . . 0.0 114.284 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -81.15 161.1 24.2 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.13 1.372 . . . . 0.0 112.245 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -87.15 171.28 10.8 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.749 2.02 . . . . 0.0 111.651 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -41.91 -59.75 2.39 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 127.487 2.315 . . . . 0.0 113.237 172.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.402 ' HB3' ' HG3' ' A' ' 62' ' ' MET . 83.4 Cg_endo -74.06 -31.34 7.99 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 122.048 1.832 . . . . 0.0 113.578 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.69 -42.84 90.76 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.874 -1.141 . . . . 0.0 111.76 177.315 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.3 mt -65.97 -53.34 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 123.451 0.7 . . . . 0.0 109.824 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -56.82 -39.16 73.66 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.262 0.937 . . . . 0.0 112.216 -174.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.1 tttm -59.6 -57.41 13.05 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.575 1.15 . . . . 0.0 112.871 177.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -63.18 -38.04 89.6 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.865 -0.522 . . . . 0.0 111.878 -178.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.672 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.0 OUTLIER -63.12 -48.77 77.12 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.62 1.168 . . . . 0.0 111.402 174.27 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.52 -41.19 72.81 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 121.389 -0.819 . . . . 0.0 113.027 173.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.54 -47.56 73.03 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -176.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.675 ' CH2' HD11 ' A' ' 47' ' ' LEU . 7.4 p-90 -73.99 -36.63 64.53 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 114.59 1.329 . . . . 0.0 114.59 168.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.07 -33.37 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 125.363 1.465 . . . . 0.0 112.326 175.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -59.9 -12.42 7.64 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.055 0.942 . . . . 0.0 112.931 177.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.1 m -109.86 -10.7 14.74 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.767 1.627 . . . . 0.0 112.537 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.675 HD11 ' CH2' ' A' ' 43' ' ' TRP . 16.4 mt . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 173.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 . . . . . 0 CA--C 1.543 0.7 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.402 ' HG3' ' HB3' ' A' ' 34' ' ' PRO . 9.8 tmm? -61.79 -51.32 68.75 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 121.514 -0.741 . . . . 0.0 112.542 175.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -63.82 -28.6 69.97 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.62 0.368 . . . . 0.0 111.399 177.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.43 -51.46 14.87 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.56 1.144 . . . . 0.0 111.916 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.48 -52.67 64.64 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.464 0.575 . . . . 0.0 110.139 174.118 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.38 -49.19 78.13 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.251 -178.026 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.36 -46.55 88.15 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.867 1.212 . . . . 0.0 113.064 177.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -66.16 -46.86 75.93 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 118.847 0.749 . . . . 0.0 112.435 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 75.7 mt -57.75 -49.38 76.76 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.463 1.105 . . . . 0.0 110.855 173.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.56 -43.93 96.72 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.188 -0.91 . . . . 0.0 112.233 177.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.7 mtpt -56.21 -50.68 70.57 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.458 1.481 . . . . 0.0 112.421 173.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.49 -51.32 67.92 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 177.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -57.09 -51.99 67.09 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.69 0.796 . . . . 0.0 111.715 175.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.08 -44.62 67.67 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.91 1.284 . . . . 0.0 112.113 176.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -57.18 -52.29 65.9 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.642 0.655 . . . . 0.0 112.583 174.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.31 -30.97 70.95 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 178.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.6 t -72.74 -25.37 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 126.79 2.036 . . . . 0.0 112.913 175.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.44 -30.68 63.15 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.178 1.547 . . . . 0.0 115.178 176.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 pttt -88.73 3.15 51.9 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 125.821 1.648 . . . . 0.0 114.181 172.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 9.1 ttm -106.31 -163.55 0.93 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.695 1.998 . . . . 0.0 111.333 -173.1 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.15 152.93 20.23 Favored Pre-proline 0 N--CA 1.481 1.091 0 C-N-CA 125.702 1.601 . . . . 0.0 114.209 178.507 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -68.52 -46.51 1.89 Allowed 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.885 3.057 . . . . 0.0 113.303 -173.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.92 -37.19 71.13 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.411 1.484 . . . . 0.0 112.49 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.0 -46.57 80.88 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.329 0.652 . . . . 0.0 109.828 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -45.39 58.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.418 1.087 . . . . 0.0 111.977 174.291 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -65.85 -51.62 57.34 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.707 1.203 . . . . 0.0 112.069 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.68 -45.2 92.78 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.167 0.987 . . . . 0.0 113.0 177.022 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.94 -36.93 70.04 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.065 -1.022 . . . . 0.0 113.234 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.79 97.21 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.496 1.044 . . . . 0.0 111.714 171.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -53.97 -50.51 66.37 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.218 1.407 . . . . 0.0 111.625 170.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 9.6 tp -59.53 -39.69 84.72 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 174.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.5 t -72.62 -38.36 67.8 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.189 -0.945 . . . . 0.0 112.684 -175.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -71.26 -48.66 49.67 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.443 0.697 . . . . 0.0 110.833 174.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.7 tt -67.12 -27.71 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.08 -34.48 70.2 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 . . . . . 0 CA--C 1.542 0.661 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 171.011 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -49.47 -35.97 21.28 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.44 1.496 . . . . 0.0 112.975 174.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -57.12 -59.38 5.17 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.595 1.158 . . . . 0.0 111.48 173.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.96 -36.92 85.94 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.582 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.63 -47.25 80.1 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.709 1.204 . . . . 0.0 110.931 174.712 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.74 -52.41 62.6 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 117.529 -1.224 . . . . 0.0 112.473 168.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 8.9 mm -52.68 -45.23 48.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 CA-C-N 119.705 1.139 . . . . 0.0 111.678 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -67.37 -45.09 77.31 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.043 0.937 . . . . 0.0 112.018 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.84 -47.37 86.65 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.57 1.148 . . . . 0.0 112.132 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -69.05 -38.62 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.879 -0.513 . . . . 0.0 111.986 173.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 71.9 t80 . . . . . 0 N--CA 1.474 0.733 0 CA-C-N 120.181 1.355 . . . . 0.0 112.859 175.8 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo . . . . . 0 CA--C 1.536 0.601 0 CA-C-O 121.875 0.698 . . . . 0.0 113.251 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 68.5 mm-40 -55.43 -27.84 50.5 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.072 0.949 . . . . 0.0 112.722 176.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.24 -51.69 68.7 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.584 1.154 . . . . 0.0 112.707 176.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -70.96 -46.37 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 O-C-N 121.609 -0.682 . . . . 0.0 109.642 175.324 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -58.48 -40.96 84.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 118.936 -1.106 . . . . 0.0 110.023 -173.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -65.54 -46.59 78.98 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.109 1.363 . . . . 0.0 112.712 173.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -37.24 79.01 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 119.591 1.087 . . . . 0.0 112.796 179.078 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.2 pp -89.01 -21.53 23.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.491 0.716 . . . . 0.0 112.825 -179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 . . . . . 0 N--CA 1.478 0.974 0 C-N-CA 125.814 1.646 . . . . 0.0 113.839 176.106 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo . . . . . 0 CA--C 1.547 1.133 0 CA-C-O 118.999 -0.5 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -68.53 -21.85 39.33 Favored 'Trans proline' 0 CA--C 1.554 1.499 0 N-CA-C 116.977 1.876 . . . . 0.0 116.977 170.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.89 166.98 27.22 Favored 'Trans proline' 0 C--N 1.362 1.269 0 CA-C-N 124.264 2.559 . . . . 0.0 112.882 176.183 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.16 148.08 84.63 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.073 2.516 . . . . 0.0 112.543 175.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -61.18 -24.66 66.47 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.492 HD13 ' H ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -112.57 32.87 5.31 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.869 2.468 . . . . 0.0 111.629 177.621 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.18 116.55 0.84 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.86 1.264 . . . . 0.0 113.148 171.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.99 -11.53 2.85 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 126.362 1.934 . . . . 0.0 113.629 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.97 158.89 52.57 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.809 1.644 . . . . 0.0 112.453 -178.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.65 174.18 12.67 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.821 2.348 . . . . 0.0 113.609 -178.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -52.09 -35.72 48.68 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.49 1.516 . . . . 0.0 113.094 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -52.9 -41.26 64.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.459 1.503 . . . . 0.0 113.178 172.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 69.7 t -80.75 -41.24 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.488 1.115 . . . . 0.0 111.828 175.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 43.2 t -56.58 -37.82 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.382 0.673 . . . . 0.0 111.299 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.2 tptt -62.12 -50.69 70.88 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.352 -0.842 . . . . 0.0 112.312 172.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.27 -46.8 76.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.523 0.729 . . . . 0.0 111.532 177.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -51.78 -53.8 35.78 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.678 1.191 . . . . 0.0 111.747 168.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.25 -47.45 83.52 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.671 1.123 . . . . 0.0 113.925 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.74 -41.33 96.01 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.155 0.582 . . . . 0.0 111.621 178.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.9 tp -60.16 -44.99 94.58 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.21 0.604 . . . . 0.0 111.42 172.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.636 HD11 HG21 ' A' ' 36' ' ' ILE . 1.5 mm? -61.7 -38.82 89.25 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.513 1.925 . . . . 0.0 114.012 178.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -54.25 -31.1 52.63 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 174.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -68.65 -44.96 73.03 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.193 0.997 . . . . 0.0 112.399 175.336 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -101.41 26.99 6.62 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.741 2.016 . . . . 0.0 112.606 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -24.95 43.79 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.903 1.281 . . . . 0.0 113.918 -179.285 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.81 -30.53 64.14 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.297 1.839 . . . . 0.0 113.262 176.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.5 mmtt -65.85 142.86 57.78 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.335 1.054 . . . . 0.0 110.212 176.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.59 158.25 34.38 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.464 0.706 . . . . 0.0 109.465 171.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -37.96 -58.99 1.27 Allowed Pre-proline 0 CA--C 1.552 1.056 0 CA-C-O 117.242 -1.361 . . . . 0.0 113.956 173.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -57.98 -44.25 41.49 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.012 3.141 . . . . 0.0 114.536 177.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -58.97 -39.01 80.42 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.922 0.889 . . . . 0.0 111.755 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.636 HG21 HD11 ' A' ' 25' ' ' LEU . 25.0 mt -66.07 -47.4 85.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 124.026 0.931 . . . . 0.0 110.362 173.069 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -52.26 -39.01 59.83 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.15 -57.35 9.88 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 122.091 0.948 . . . . 0.0 113.164 170.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -32.49 74.0 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.284 -0.885 . . . . 0.0 112.551 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.725 HD13 ' HE1' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -62.31 -49.97 73.51 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.015 1.326 . . . . 0.0 110.77 170.942 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -54.66 -35.53 63.62 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.893 0.877 . . . . 0.0 113.131 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.36 45.04 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.725 ' HE1' HD13 ' A' ' 40' ' ' LEU . 9.7 p-90 -73.79 -33.83 64.39 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 174.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.422 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -57.74 -31.57 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.401 1.48 . . . . 0.0 111.656 174.663 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -57.8 -17.84 18.32 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.383 0.992 . . . . 0.0 112.82 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.68 -11.32 23.64 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.172 1.389 . . . . 0.0 113.223 176.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.567 HD11 ' CH2' ' A' ' 43' ' ' TRP . 30.5 mt . . . . . 0 N--CA 1.475 0.796 0 CA-C-N 119.079 0.854 . . . . 0.0 112.618 171.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -59.78 -53.41 58.25 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 123.742 0.817 . . . . 0.0 112.451 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.5 mttm -57.36 -34.47 68.84 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.216 1.006 . . . . 0.0 112.195 175.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.01 -51.38 32.77 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.882 0.873 . . . . 0.0 111.747 178.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.34 -52.45 65.3 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.321 1.048 . . . . 0.0 110.388 176.108 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -61.31 -49.84 75.4 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.202 1.001 . . . . 0.0 111.951 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.61 -48.72 78.65 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.511 1.505 . . . . 0.0 112.753 177.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -62.44 -53.96 47.23 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.184 0.594 . . . . 0.0 111.988 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.5 tp -54.09 -51.27 64.68 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.08 1.352 . . . . 0.0 110.354 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.81 -48.19 82.14 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 124.119 0.968 . . . . 0.0 111.393 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.96 -50.59 68.52 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 120.747 1.612 . . . . 0.0 112.315 176.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.0 -50.89 71.97 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.628 0.771 . . . . 0.0 112.666 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -58.76 -48.96 79.41 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.746 1.219 . . . . 0.0 110.932 178.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -54.38 -44.31 72.17 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.606 1.962 . . . . 0.0 112.539 174.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -59.02 -50.54 73.71 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.472 0.709 . . . . 0.0 112.014 175.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.19 -38.16 90.07 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 121.221 0.534 . . . . 0.0 112.286 175.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.8 t -69.02 -27.56 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 C-N-CA 125.84 1.656 . . . . 0.0 112.868 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.18 -22.04 6.0 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 174.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.2 pttt -116.45 1.52 12.99 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.96 1.704 . . . . 0.0 114.566 174.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 31.9 tpp -86.56 -83.86 0.18 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.754 1.621 . . . . 0.0 111.175 -177.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.7 150.72 76.57 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 127.579 2.351 . . . . 0.0 112.452 -175.19 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -71.22 -49.7 0.36 Allowed 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 123.899 3.066 . . . . 0.0 113.372 -176.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.4 -37.97 89.4 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.857 1.263 . . . . 0.0 112.2 177.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.69 -36.06 82.61 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.316 0.646 . . . . 0.0 110.774 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.73 -48.32 66.77 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.087 0.955 . . . . 0.0 111.603 173.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 mttm -63.92 -53.3 52.54 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.238 1.015 . . . . 0.0 111.199 177.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -53.46 -55.49 24.83 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.281 0.632 . . . . 0.0 112.275 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -67.79 -37.67 82.34 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.718 0.807 . . . . 0.0 112.67 -176.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.5 -49.41 77.66 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.398 -0.814 . . . . 0.0 111.076 172.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.21 -41.02 87.61 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.464 1.106 . . . . 0.0 112.526 175.271 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.414 ' HA ' HG22 ' A' ' 94' ' ' ILE . 7.5 mp -66.88 -38.93 87.22 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 119.352 0.978 . . . . 0.0 112.608 172.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.5 t -71.4 -42.63 68.1 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 120.473 -1.392 . . . . 0.0 113.022 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -49.56 68.42 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.324 0.65 . . . . 0.0 109.614 174.114 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.414 HG22 ' HA ' ' A' ' 91' ' ' LEU . 8.8 tp -65.46 -28.14 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -178.185 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.61 -26.87 68.26 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 177.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 . . . . . 0 CA--C 1.547 0.832 0 C-N-CA 124.379 1.071 . . . . 0.0 113.173 173.891 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -43.71 -35.8 1.97 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.502 1.521 . . . . 0.0 114.032 170.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -60.95 -59.38 5.46 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.599 0.76 . . . . 0.0 111.536 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.11 -31.54 72.79 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.831 0.741 . . . . 0.0 111.892 -176.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.36 -52.33 65.71 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.451 0.301 . . . . 0.0 111.445 172.223 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -54.67 -46.87 74.1 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 117.91 -1.043 . . . . 0.0 111.646 174.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 27.4 mm -52.97 -49.81 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.355 1.062 . . . . 0.0 111.731 174.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 68.6 mm-40 -64.41 -46.22 84.21 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.064 1.302 . . . . 0.0 112.947 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.39 -48.9 77.84 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.124 0.969 . . . . 0.0 111.725 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.59 -40.09 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.161 173.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 87.6 t80 . . . . . 0 N--CA 1.474 0.745 0 CA-C-N 120.304 1.411 . . . . 0.0 113.439 -179.465 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo . . . . . 0 CA--C 1.537 0.625 0 CA-C-O 121.638 0.599 . . . . 0.0 112.188 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -60.89 -24.66 66.15 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 174.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 71.5 m -62.7 -51.61 66.54 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 120.009 1.277 . . . . 0.0 112.044 176.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.6 p -70.22 -38.94 76.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 121.905 -0.497 . . . . 0.0 111.137 176.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.2 tttt -61.21 -45.69 93.52 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.109 0.868 . . . . 0.0 112.071 177.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -69.87 -39.43 76.32 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.057 0.943 . . . . 0.0 113.05 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -67.54 -36.74 81.56 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.199 -0.938 . . . . 0.0 112.412 176.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.23 -19.44 31.64 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.351 1.06 . . . . 0.0 113.26 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 . . . . . 0 N--CA 1.479 0.986 0 C-N-CA 125.951 1.7 . . . . 0.0 113.833 178.158 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo . . . . . 0 CA--C 1.54 0.821 0 CA-C-O 119.154 -0.436 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -68.67 -23.06 36.76 Favored 'Trans proline' 0 CA--C 1.551 1.335 0 CA-C-O 115.882 -1.799 . . . . 0.0 115.511 167.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.02 160.47 49.22 Favored 'Trans proline' 0 C--N 1.363 1.314 0 CA-C-N 124.122 2.508 . . . . 0.0 112.537 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -64.87 130.14 25.24 Favored 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 123.54 2.827 . . . . 0.0 111.454 174.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -52.1 -49.78 62.92 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.125 -0.984 . . . . 0.0 112.505 174.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.16 -2.07 17.33 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -15.48 99.12 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.782 2.833 . . . . 0.0 115.192 -175.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 162.61 -21.69 0.19 Allowed Glycine 0 CA--C 1.537 1.413 0 C-N-CA 124.549 1.071 . . . . 0.0 114.98 -177.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.17 161.56 72.63 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 124.54 1.136 . . . . 0.0 113.135 176.064 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.47 172.67 15.67 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.438 2.758 . . . . 0.0 113.991 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -52.84 -36.34 58.66 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.991 1.316 . . . . 0.0 113.33 -179.055 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -54.05 -39.91 66.64 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.513 1.525 . . . . 0.0 112.7 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 72.3 t -83.29 -39.87 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.536 1.534 . . . . 0.0 111.754 176.094 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 59.4 t -55.9 -39.72 58.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.066 0.946 . . . . 0.0 111.022 177.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 tptm -60.57 -50.64 72.74 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.718 0.807 . . . . 0.0 111.935 172.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.78 -47.15 74.32 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.672 0.669 . . . . 0.0 111.945 178.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.52 ' CD1' HD11 ' A' ' 40' ' ' LEU . 10.3 t80 -53.48 -53.47 51.03 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.459 1.104 . . . . 0.0 112.06 168.63 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.21 -47.42 83.51 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 119.086 0.857 . . . . 0.0 113.136 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.15 -37.65 88.07 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.793 0.837 . . . . 0.0 112.054 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.9 tp -60.57 -52.55 64.67 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.559 0.744 . . . . 0.0 111.193 171.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.562 HD21 HD21 ' A' ' 40' ' ' LEU . 3.8 mm? -71.28 -27.34 63.36 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.019 1.328 . . . . 0.0 113.601 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.5 mmtt -52.48 -48.07 66.15 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.029 1.731 . . . . 0.0 112.687 173.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 tttt -67.08 -24.03 65.92 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 178.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -109.75 30.48 6.64 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.32 2.248 . . . . 0.0 112.46 178.473 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -54.83 -23.3 17.68 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 119.976 -1.703 . . . . 0.0 113.917 -173.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.7 p -77.08 8.17 4.19 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.715 2.806 . . . . 0.0 114.989 172.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.09 171.95 0.23 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.25 1.82 . . . . 0.0 114.112 170.278 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 m -138.17 170.07 16.68 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 127.773 2.429 . . . . 0.0 109.409 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -40.14 -56.76 3.17 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 127.335 2.254 . . . . 0.0 113.436 175.043 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.64 -36.51 14.36 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 122.51 2.14 . . . . 0.0 113.856 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.93 -40.91 95.76 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.556 1.071 . . . . 0.0 111.064 178.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 22.6 mt -62.57 -53.39 47.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.44 -38.45 91.17 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 119.017 -1.073 . . . . 0.0 111.909 -175.074 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.7 ttmt -65.19 -60.17 3.29 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 125.103 1.361 . . . . 0.0 112.138 177.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -59.41 -38.62 81.07 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.678 0.672 . . . . 0.0 112.197 -179.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.58 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.0 OUTLIER -66.22 -51.15 60.46 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.474 176.4 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -59.01 -33.3 70.56 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.99 -52.17 65.14 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.686 ' CH2' HD11 ' A' ' 47' ' ' LEU . 8.7 p-90 -73.91 -35.02 64.59 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 114.376 1.251 . . . . 0.0 114.376 169.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -57.6 -27.8 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 O-C-N 120.266 -1.521 . . . . 0.0 111.795 176.085 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -56.17 -25.75 47.86 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.775 0.83 . . . . 0.0 112.501 176.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 38.7 p -88.65 -20.97 24.22 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.686 HD11 ' CH2' ' A' ' 43' ' ' TRP . 41.3 mt . . . . . 0 CA--C 1.541 0.616 0 CA-C-N 118.433 0.56 . . . . 0.0 111.909 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 . . . . . 0 N--CA 1.473 0.693 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.72 -53.31 56.32 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.525 1.13 . . . . 0.0 112.917 176.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 6.2 mtpp -56.66 -36.17 69.25 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 119.053 -0.499 . . . . 0.0 111.847 174.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.14 -49.9 52.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.814 0.846 . . . . 0.0 111.673 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.9 tttt -58.95 -51.16 71.24 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.412 1.085 . . . . 0.0 110.827 177.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.94 -50.1 74.78 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.682 1.193 . . . . 0.0 112.134 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.52 -49.97 71.18 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.179 0.9 . . . . 0.0 113.118 176.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -63.96 -47.11 81.71 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.465 0.706 . . . . 0.0 112.505 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.6 mt -56.46 -46.79 80.19 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.897 0.879 . . . . 0.0 112.032 173.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.25 -48.43 81.49 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.273 1.029 . . . . 0.0 111.182 177.055 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -50.87 67.41 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 119.963 1.256 . . . . 0.0 112.039 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.61 -48.92 75.38 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.376 0.67 . . . . 0.0 112.345 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.9 m80 -55.51 -54.09 48.29 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.961 0.904 . . . . 0.0 111.515 173.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -54.52 -41.04 69.21 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.897 1.679 . . . . 0.0 112.673 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -51.3 69.34 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.822 0.849 . . . . 0.0 111.935 174.058 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.07 -29.29 69.03 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 175.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 63.8 t -73.02 -28.44 26.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.65 1.98 . . . . 0.0 112.286 175.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.86 -36.36 58.9 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 174.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -90.98 2.17 56.49 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.642 1.577 . . . . 0.0 113.987 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 3.9 ttm -97.43 -77.02 0.5 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.421 1.488 . . . . 0.0 111.519 -174.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.71 149.56 73.33 Favored Pre-proline 0 N--CA 1.481 1.122 0 C-N-CA 126.285 1.834 . . . . 0.0 112.806 -176.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.24 -46.53 0.66 Allowed 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.768 2.978 . . . . 0.0 113.184 -177.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -68.02 -33.06 73.87 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.565 1.146 . . . . 0.0 112.523 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.59 76.04 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.915 0.486 . . . . 0.0 111.228 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.11 -51.77 65.36 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.857 0.753 . . . . 0.0 110.594 169.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -57.27 -54.7 43.82 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.513 1.125 . . . . 0.0 110.849 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.48 -52.53 65.2 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.22 -34.86 78.98 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.352 0.661 . . . . 0.0 112.432 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.3 -48.12 76.85 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 119.716 1.143 . . . . 0.0 110.774 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.25 -45.68 76.08 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.051 0.941 . . . . 0.0 112.34 171.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 8.3 tp -63.1 -39.14 93.82 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 118.836 0.744 . . . . 0.0 112.67 174.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.0 t -71.92 -41.72 67.54 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 120.603 -1.31 . . . . 0.0 112.238 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.61 -42.49 78.06 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.283 0.633 . . . . 0.0 110.869 176.779 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.9 tp -70.07 -31.46 47.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 118.46 0.573 . . . . 0.0 112.311 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.09 -31.7 72.17 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 . . . . . 0 CA--C 1.545 0.781 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 172.486 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -47.96 -34.19 8.84 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.508 1.523 . . . . 0.0 113.536 172.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -59.2 5.77 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 118.775 0.716 . . . . 0.0 111.304 173.711 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.89 79.23 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.538 0.735 . . . . 0.0 112.488 -179.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -53.91 -52.23 61.2 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.421 1.088 . . . . 0.0 110.714 169.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -49.61 75.54 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 117.631 -1.176 . . . . 0.0 111.509 175.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.5 mm -54.21 -49.58 61.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 119.53 1.059 . . . . 0.0 111.501 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 69.5 mm-40 -62.06 -44.74 96.03 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.301 -0.874 . . . . 0.0 112.369 176.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.61 -48.95 78.58 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 119.131 0.878 . . . . 0.0 112.329 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -67.15 -35.76 75.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.514 0.725 . . . . 0.0 111.85 176.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.7 t80 . . . . . 0 CA--C 1.542 0.662 0 C-N-CA 123.881 0.872 . . . . 0.0 112.947 175.242 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo . . . . . 0 CA--C 1.535 0.54 0 CA-C-O 121.863 0.693 . . . . 0.0 112.645 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -61.45 -27.6 68.68 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.538 -0.726 . . . . 0.0 112.174 177.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 22.7 t -61.14 -51.69 68.01 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.641 1.109 . . . . 0.0 112.129 177.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.2 p -74.99 -38.76 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.612 -0.68 . . . . 0.0 111.804 178.233 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -56.98 -51.15 70.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.626 171.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -63.95 -43.52 95.57 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.015 1.28 . . . . 0.0 112.699 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -66.51 -34.43 77.89 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.256 0.935 . . . . 0.0 112.804 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.34 -23.88 24.46 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.207 1.003 . . . . 0.0 113.242 178.104 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 . . . . . 0 N--CA 1.48 1.046 0 C-N-CA 126.472 1.909 . . . . 0.0 113.187 -179.971 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo . . . . . 0 CA--C 1.541 0.826 0 CA-C-O 119.14 -0.441 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -71.6 -21.3 25.82 Favored 'Trans proline' 0 CA--C 1.553 1.433 0 CA-C-O 115.714 -1.869 . . . . 0.0 116.287 167.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.83 165.98 29.22 Favored 'Trans proline' 0 C--N 1.362 1.275 0 CA-C-N 124.36 2.593 . . . . 0.0 112.356 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.432 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 35.2 Cg_endo -58.77 131.5 42.45 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.52 2.146 . . . . 0.0 111.019 169.588 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -49.89 -49.6 49.01 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.999 0.52 . . . . 0.0 110.734 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.546 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.2 pt? -80.24 28.54 0.3 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.671 1.988 . . . . 0.0 115.081 176.635 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -40.32 107.62 0.07 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.494 1.518 . . . . 0.0 114.297 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.55 17.11 0.3 Allowed Glycine 0 CA--C 1.537 1.466 0 C-N-CA 124.784 1.183 . . . . 0.0 115.044 -174.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.67 158.23 36.15 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.842 1.657 . . . . 0.0 112.132 -173.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -73.0 167.18 28.05 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.778 2.319 . . . . 0.0 112.732 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -53.78 -38.74 64.78 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.61 1.164 . . . . 0.0 113.093 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.96 -40.14 63.48 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.586 1.554 . . . . 0.0 112.825 173.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.9 t -82.75 -39.71 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.029 1.332 . . . . 0.0 111.713 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.8 t -56.03 -40.25 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.863 0.756 . . . . 0.0 110.955 176.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.4 tptt -61.26 -50.52 72.7 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.081 -1.012 . . . . 0.0 111.866 174.084 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.0 75.01 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.43 0.692 . . . . 0.0 112.025 178.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.432 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 1.5 t80 -52.82 -53.75 44.11 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.728 1.211 . . . . 0.0 112.273 168.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.66 -47.37 85.9 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.646 1.112 . . . . 0.0 113.579 -178.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -61.15 -38.77 87.62 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.849 0.86 . . . . 0.0 111.407 176.077 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.5 tp -64.15 -47.69 78.92 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 121.819 -0.55 . . . . 0.0 111.465 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.61 -35.52 76.32 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.576 1.55 . . . . 0.0 114.26 -178.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.22 -31.0 61.12 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.348 1.431 . . . . 0.0 113.025 175.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -70.38 -36.43 74.11 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.721 1.608 . . . . 0.0 112.507 176.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -109.81 20.18 18.31 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.438 1.895 . . . . 0.0 112.375 -176.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -26.1 66.6 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.053 -1.654 . . . . 0.0 113.5 -175.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 33.0 p -85.27 -0.32 54.33 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.659 2.384 . . . . 0.0 114.379 177.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -82.69 167.91 17.76 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 125.418 1.487 . . . . 0.0 112.609 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.21 171.52 9.44 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.926 2.09 . . . . 0.0 111.94 178.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -46.04 -61.16 2.73 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 126.746 2.018 . . . . 0.0 112.595 172.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.35 -38.32 20.75 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 121.894 1.729 . . . . 0.0 112.744 177.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -42.07 99.35 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 120.444 -1.41 . . . . 0.0 112.684 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.1 mt -68.18 -53.34 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 124.25 1.02 . . . . 0.0 110.385 173.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -56.9 -37.62 71.67 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.368 0.986 . . . . 0.0 112.468 -174.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -59.47 -56.99 15.07 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.146 1.378 . . . . 0.0 111.919 177.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -65.59 -35.2 80.15 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.688 0.395 . . . . 0.0 111.919 -178.096 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.775 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.8 mm? -61.32 -51.07 70.4 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.053 1.341 . . . . 0.0 112.229 170.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -60.71 -36.94 80.07 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.25 -0.906 . . . . 0.0 112.862 177.17 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.34 -49.16 72.95 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.775 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.2 p-90 -73.7 -35.59 65.15 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 170.672 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -56.63 -31.59 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 125.393 1.477 . . . . 0.0 112.229 175.2 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -57.6 -19.61 27.16 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 119.027 0.831 . . . . 0.0 112.906 176.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.7 -15.35 23.98 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.119 1.367 . . . . 0.0 113.727 174.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.674 HD11 ' CH2' ' A' ' 43' ' ' TRP . 48.7 mt . . . . . 0 N--CA 1.472 0.663 0 CA-C-N 118.924 0.784 . . . . 0.0 112.453 174.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 . . . . . 0 N--CA 1.47 0.56 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -61.61 -53.34 57.52 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.897 0.879 . . . . 0.0 112.869 176.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt -60.67 -32.29 71.5 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 118.997 -0.525 . . . . 0.0 111.82 175.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.34 -51.61 35.3 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.796 0.838 . . . . 0.0 111.15 178.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.8 ttmt -61.06 -48.1 83.29 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.214 0.461 . . . . 0.0 110.593 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.94 -51.82 68.06 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.578 1.151 . . . . 0.0 112.707 177.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.67 -43.75 90.01 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.782 1.174 . . . . 0.0 112.858 177.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -63.22 -50.45 70.19 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.656 0.782 . . . . 0.0 112.022 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.3 mt -57.1 -50.81 71.63 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.113 0.965 . . . . 0.0 111.171 176.23 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.42 -45.33 84.74 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.991 0.917 . . . . 0.0 112.283 175.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -59.04 -50.78 72.79 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-N 120.766 1.621 . . . . 0.0 111.781 177.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.28 75.81 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -56.63 -52.28 65.46 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.932 0.893 . . . . 0.0 110.699 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.45 -41.61 73.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.973 1.309 . . . . 0.0 113.224 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -57.83 -52.42 65.53 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.931 0.892 . . . . 0.0 112.255 173.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.57 -36.06 82.66 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 176.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 37.3 t -68.59 -27.83 37.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 126.321 1.848 . . . . 0.0 113.166 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.6 -29.29 37.0 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 175.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.6 pttt -105.89 0.43 25.89 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.187 1.795 . . . . 0.0 113.795 176.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 45.8 ttm -93.44 -80.55 0.38 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.127 1.771 . . . . 0.0 111.799 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.91 143.82 49.15 Favored Pre-proline 0 N--CA 1.48 1.041 0 C-N-CA 126.997 2.119 . . . . 0.0 112.655 -175.024 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -68.21 -49.83 0.88 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 123.666 2.91 . . . . 0.0 113.304 -178.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.43 -37.01 86.04 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.241 1.416 . . . . 0.0 113.04 176.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.4 -40.09 95.13 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 118.761 -0.638 . . . . 0.0 110.062 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 12.5 tppt? -55.76 -50.18 71.13 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.478 171.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 50.4 mmtt -54.96 -54.6 40.74 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.266 0.939 . . . . 0.0 110.727 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.38 -47.57 81.5 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -71.0 -38.93 72.67 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.107 0.963 . . . . 0.0 112.285 -177.33 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.25 -47.88 82.4 Favored 'General case' 0 N--CA 1.465 0.297 0 O-C-N 121.052 -1.03 . . . . 0.0 111.409 171.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -56.85 -43.7 81.41 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.757 0.708 . . . . 0.0 112.225 172.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 13.0 tp -62.44 -39.94 94.97 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.722 1.147 . . . . 0.0 113.018 172.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.5 t -70.67 -45.16 65.59 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.857 -1.152 . . . . 0.0 112.81 -177.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -41.93 79.71 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.6 0.76 . . . . 0.0 110.984 175.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.3 tt -70.85 -29.73 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 179.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.49 -34.83 71.34 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 . . . . . 0 CA--C 1.544 0.746 0 C-N-CA 124.399 1.08 . . . . 0.0 113.479 172.133 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 2.4 tp . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -46.64 -38.1 9.2 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.484 1.113 . . . . 0.0 113.092 173.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -62.52 -59.15 5.35 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.552 0.741 . . . . 0.0 112.039 171.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.5 -36.13 83.19 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.976 0.91 . . . . 0.0 112.815 -175.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -53.68 -54.65 34.9 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 126.636 1.974 . . . . 0.0 110.866 166.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.0 tttt -52.63 -52.09 57.08 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 117.686 -1.15 . . . . 0.0 110.597 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.9 mm -52.27 -50.96 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 119.44 1.018 . . . . 0.0 111.471 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -64.84 -42.57 94.8 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.1 0.864 . . . . 0.0 112.549 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.52 -36.13 83.22 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.887 1.275 . . . . 0.0 113.044 179.267 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.7 pp -78.13 -42.56 27.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 119.165 0.893 . . . . 0.0 111.856 170.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 58.6 t80 . . . . . 0 N--CA 1.473 0.725 0 C-N-CA 124.84 1.256 . . . . 0.0 113.187 179.149 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo . . . . . 0 CA--C 1.538 0.704 0 CA-C-O 121.498 0.541 . . . . 0.0 112.899 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -63.39 -20.49 65.59 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 175.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.2 p -65.42 -51.55 59.52 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.933 1.242 . . . . 0.0 112.21 176.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.2 p -72.56 -39.08 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.649 -0.657 . . . . 0.0 111.424 176.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 29.1 mtmt -57.87 -50.15 74.3 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.034 0.834 . . . . 0.0 111.8 173.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -65.88 -40.76 91.9 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.552 1.069 . . . . 0.0 113.551 177.453 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.22 -35.35 79.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.575 1.08 . . . . 0.0 112.873 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.46 -23.33 26.03 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.356 1.063 . . . . 0.0 113.418 178.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 . . . . . 0 N--CA 1.48 1.054 0 C-N-CA 126.609 1.964 . . . . 0.0 113.834 177.095 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo . . . . . 0 CA--C 1.547 1.158 0 CA-C-O 119.147 -0.439 . . . . 0.0 111.726 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.04 -21.43 27.61 Favored 'Trans proline' 0 CA--C 1.555 1.569 0 C-N-CA 122.523 2.149 . . . . 0.0 116.55 166.119 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.36 170.25 17.73 Favored 'Trans proline' 0 C--N 1.363 1.308 0 CA-C-N 124.18 2.529 . . . . 0.0 112.762 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -62.47 123.64 12.78 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.578 2.186 . . . . 0.0 110.846 173.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -52.87 -38.2 61.32 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 122.163 0.982 . . . . 0.0 111.868 169.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.492 ' HB3' HG21 ' A' ' 44' ' ' VAL . 0.5 OUTLIER -83.82 22.42 1.13 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 128.709 2.804 . . . . 0.0 115.064 175.324 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -41.0 113.22 0.37 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.657 1.583 . . . . 0.0 113.44 175.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.94 23.28 0.19 Allowed Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.207 1.384 . . . . 0.0 114.742 -175.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -125.2 158.85 62.18 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 125.789 1.636 . . . . 0.0 112.347 -172.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.37 170.72 19.69 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.211 2.607 . . . . 0.0 113.106 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -52.45 -38.27 58.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.81 1.244 . . . . 0.0 113.277 -177.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -56.22 -40.2 73.7 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.623 1.569 . . . . 0.0 112.349 176.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 79.7 t -79.46 -39.55 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.963 1.305 . . . . 0.0 111.809 174.139 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 57.8 t -55.65 -38.94 52.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.0 0.92 . . . . 0.0 111.037 177.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -60.43 -50.63 72.81 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.799 -1.188 . . . . 0.0 112.221 174.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.67 -47.62 79.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.361 1.064 . . . . 0.0 111.616 177.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.63 -51.7 46.45 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.167 0.987 . . . . 0.0 111.671 168.637 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.54 -47.15 86.88 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 120.183 1.356 . . . . 0.0 113.287 -176.355 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -65.45 -34.18 77.68 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 122.545 0.338 . . . . 0.0 111.692 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.95 -54.63 14.32 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 173.071 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.6 HD22 HD21 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -57.26 -34.17 68.36 Favored 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 123.871 0.868 . . . . 0.0 112.517 -178.503 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -51.5 -30.54 20.51 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 171.104 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.8 tttt -74.91 -36.08 62.22 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.778 1.231 . . . . 0.0 113.145 173.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -102.64 15.08 30.32 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.499 1.52 . . . . 0.0 113.052 -177.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -63.36 -19.74 64.91 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.477 -1.39 . . . . 0.0 113.385 -172.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -100.4 1.04 40.99 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 126.947 2.099 . . . . 0.0 113.773 -178.627 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -79.38 177.73 8.63 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.786 1.635 . . . . 0.0 111.819 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.93 172.1 8.36 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.864 2.066 . . . . 0.0 111.938 177.121 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -49.56 -59.24 7.05 Favored Pre-proline 0 CA--C 1.546 0.793 0 C-N-CA 124.721 1.208 . . . . 0.0 113.107 175.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.21 -36.93 15.3 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.868 1.712 . . . . 0.0 112.607 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.74 -49.41 77.6 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.896 -1.127 . . . . 0.0 112.182 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.0 mt -61.94 -53.42 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-O 117.928 -1.034 . . . . 0.0 109.289 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -51.83 -44.87 63.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.301 1.41 . . . . 0.0 111.677 -176.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -51.13 68.34 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 125.108 1.363 . . . . 0.0 112.994 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.62 -39.14 92.87 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.106 0.562 . . . . 0.0 112.479 176.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.72 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.4 mm? -61.68 -50.18 73.52 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.518 1.127 . . . . 0.0 109.848 173.284 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.567 ' HA ' HG12 ' A' ' 44' ' ' VAL . 3.8 m-20 -62.74 -28.38 69.93 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 178.24 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.34 -54.8 39.09 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.465 -0.772 . . . . 0.0 112.667 174.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.72 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.3 p-90 -73.84 -30.42 62.66 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 175.612 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.804 HG23 HD12 ' A' ' 47' ' ' LEU . 0.3 OUTLIER -67.35 -29.67 46.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 120.623 -1.298 . . . . 0.0 112.667 175.567 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -58.95 -15.55 13.48 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.012 0.824 . . . . 0.0 113.147 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.9 p -115.07 -2.99 12.64 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.363 1.465 . . . . 0.0 113.56 177.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.804 HD12 HG23 ' A' ' 44' ' ' VAL . 9.7 mt . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 175.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 . . . . . 0 N--CA 1.473 0.717 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.0 ttt -64.01 -51.28 64.95 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.631 0.772 . . . . 0.0 112.424 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -52.93 -40.04 63.31 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 122.972 0.509 . . . . 0.0 111.86 172.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.14 -48.84 64.27 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.336 0.655 . . . . 0.0 111.244 -178.316 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -60.13 -53.08 62.03 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.046 0.938 . . . . 0.0 110.389 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -60.12 -50.46 73.6 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.569 1.147 . . . . 0.0 112.437 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.68 -47.33 86.08 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.261 0.937 . . . . 0.0 112.176 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.31 -45.12 85.64 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.252 -0.905 . . . . 0.0 112.823 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.4 mp -56.18 -47.64 77.9 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.735 0.814 . . . . 0.0 110.535 171.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.49 -47.18 84.93 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 117.678 -1.153 . . . . 0.0 111.933 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -56.18 -50.31 71.56 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 121.609 2.004 . . . . 0.0 113.376 175.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.07 -50.35 70.94 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.796 -0.565 . . . . 0.0 112.239 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 34.2 m170 -55.97 -41.13 74.28 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-O 117.694 -1.146 . . . . 0.0 111.354 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -51.03 71.71 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 126.182 1.793 . . . . 0.0 112.398 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -58.99 -47.16 86.15 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.3 176.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.1 -51.04 63.71 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 176.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 41.5 t -59.42 -28.56 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 126.976 2.11 . . . . 0.0 112.586 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.93 -28.57 24.12 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 173.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -101.73 -0.51 34.31 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.028 1.331 . . . . 0.0 114.354 176.259 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.1 mmt -88.23 -85.73 0.18 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.594 1.158 . . . . 0.0 110.775 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -129.7 155.22 80.71 Favored Pre-proline 0 N--CA 1.476 0.853 0 C-N-CA 127.039 2.135 . . . . 0.0 112.945 -176.179 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.5 -51.79 0.31 Allowed 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.76 2.973 . . . . 0.0 112.846 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -62.85 -34.18 76.82 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.463 1.505 . . . . 0.0 113.217 177.227 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -42.61 99.75 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 118.938 -0.553 . . . . 0.0 110.437 178.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.53 -45.85 77.11 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 117.909 -1.043 . . . . 0.0 110.951 171.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.4 mttt -58.08 -54.76 43.35 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.122 1.328 . . . . 0.0 111.839 177.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.62 -54.98 40.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.452 0.701 . . . . 0.0 112.498 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.68 -46.88 77.53 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.331 1.052 . . . . 0.0 112.758 175.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.84 -43.33 99.06 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.55 1.068 . . . . 0.0 111.502 -179.18 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.18 -46.91 82.42 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.082 0.953 . . . . 0.0 111.881 170.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.434 ' HA ' HG22 ' A' ' 94' ' ' ILE . 6.9 mp -63.53 -32.51 73.99 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 173.52 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.3 t -73.25 -41.45 63.67 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.783 1.233 . . . . 0.0 112.571 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -71.36 -44.36 65.17 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.485 -0.759 . . . . 0.0 111.023 176.052 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.434 HG22 ' HA ' ' A' ' 91' ' ' LEU . 15.8 tt -69.53 -30.07 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 178.59 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.06 -41.78 68.53 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.134 0.879 . . . . 0.0 112.388 176.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 . . . . . 0 CA--C 1.544 0.744 0 C-N-CA 124.858 1.263 . . . . 0.0 113.518 177.178 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.457 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.477 0.882 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.44 -37.68 39.39 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.417 1.087 . . . . 0.0 112.94 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.5 mtmt -60.32 -59.41 5.45 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.599 0.76 . . . . 0.0 111.135 173.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.457 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -62.88 -36.17 82.43 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.72 0.808 . . . . 0.0 112.916 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.7 -53.23 57.58 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.42 1.088 . . . . 0.0 110.802 170.527 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 50.6 tttt -55.04 -50.69 68.44 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.654 0.782 . . . . 0.0 111.66 175.45 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 23.5 mm -51.6 -48.75 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.688 1.195 . . . . 0.0 111.059 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -64.87 -42.58 94.73 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 120.17 1.35 . . . . 0.0 113.025 177.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.94 -40.96 99.22 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.856 0.863 . . . . 0.0 112.979 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -75.88 -35.39 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 121.378 -0.827 . . . . 0.0 111.782 172.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 47.7 t80 . . . . . 0 N--CA 1.469 0.508 0 C-N-CA 124.619 1.168 . . . . 0.0 112.889 179.491 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo . . . . . 0 CA--C 1.537 0.632 0 CA-C-O 121.824 0.677 . . . . 0.0 112.586 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -26.28 53.92 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 174.324 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.2 t -59.4 -51.65 68.98 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.629 1.104 . . . . 0.0 111.924 179.088 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.8 -49.19 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.706 -0.621 . . . . 0.0 109.759 173.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -58.42 -37.52 75.54 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.59 -171.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -67.85 -46.28 72.2 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.78 1.632 . . . . 0.0 113.675 170.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -59.43 -34.08 72.04 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.85 1.204 . . . . 0.0 112.959 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.4 pp -91.87 -20.86 21.0 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.784 1.234 . . . . 0.0 113.651 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.475 0.804 0 CA-C-N 119.745 1.157 . . . . 0.0 112.412 171.323 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 CA--C 1.546 1.076 0 CA-C-O 119.126 -0.448 . . . . 0.0 111.688 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -71.81 -22.09 24.06 Favored 'Trans proline' 0 CA--C 1.553 1.455 0 C-N-CA 122.102 1.868 . . . . 0.0 116.469 167.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.88 166.45 27.7 Favored 'Trans proline' 0 C--N 1.363 1.326 0 CA-C-N 124.332 2.583 . . . . 0.0 112.276 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.422 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 40.2 Cg_endo -58.82 129.39 31.95 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.706 2.27 . . . . 0.0 110.843 171.145 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -48.68 -48.59 39.89 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 122.826 0.45 . . . . 0.0 111.296 172.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.583 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.9 pt? -83.33 29.29 0.5 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.508 1.923 . . . . 0.0 114.419 178.365 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -37.6 104.19 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.035 1.734 . . . . 0.0 114.919 -179.105 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 147.55 11.0 0.18 Allowed Glycine 0 CA--C 1.542 1.741 0 C-N-CA 125.626 1.584 . . . . 0.0 115.683 -173.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -109.54 159.26 32.18 Favored Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 125.745 1.618 . . . . 0.0 112.612 -172.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -73.98 169.55 22.14 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 123.019 2.479 . . . . 0.0 113.32 179.073 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -54.62 -38.09 66.39 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.656 1.183 . . . . 0.0 113.267 -177.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -53.39 -39.98 64.69 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.74 1.616 . . . . 0.0 112.486 174.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.2 t -82.08 -38.96 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 124.863 1.265 . . . . 0.0 112.077 176.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.7 t -56.71 -38.77 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 119.02 0.827 . . . . 0.0 111.337 176.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -62.65 -50.38 71.44 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.366 -0.834 . . . . 0.0 112.549 174.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.39 -47.76 75.35 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.083 0.953 . . . . 0.0 111.704 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.422 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 15.5 t80 -51.18 -52.96 39.27 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.265 1.026 . . . . 0.0 111.897 168.493 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -47.4 85.72 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.02 0.827 . . . . 0.0 113.124 -177.703 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -65.18 -37.84 88.62 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.229 0.612 . . . . 0.0 111.772 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.2 tp -59.27 -52.24 66.49 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.063 0.545 . . . . 0.0 110.884 169.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.62 -29.11 70.37 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -179.246 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.9 mttm -54.15 -35.56 62.37 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.349 1.431 . . . . 0.0 112.9 172.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.57 -32.8 60.52 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.29 1.036 . . . . 0.0 113.118 175.374 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -97.69 16.65 19.95 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.166 1.786 . . . . 0.0 113.367 179.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.6 -17.05 64.3 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 119.787 -1.82 . . . . 0.0 113.867 -170.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.7 p -100.82 1.58 40.26 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 128.051 2.54 . . . . 0.0 113.771 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -79.72 165.48 22.78 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.921 1.688 . . . . 0.0 112.592 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.89 171.02 9.89 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.962 1.705 . . . . 0.0 111.97 176.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -47.91 -59.76 5.3 Favored Pre-proline 0 N--CA 1.474 0.732 0 C-N-CA 126.343 1.857 . . . . 0.0 113.078 174.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -65.16 -30.61 55.26 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 122.118 1.879 . . . . 0.0 113.43 179.091 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.44 -44.95 63.89 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.639 1.175 . . . . 0.0 111.963 -178.59 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 80.0 mt -66.57 -53.04 39.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.702 0.801 . . . . 0.0 109.647 172.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.95 -36.49 72.61 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 118.774 0.715 . . . . 0.0 111.837 -174.577 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -61.41 -60.44 3.71 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 125.382 1.473 . . . . 0.0 113.687 175.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -35.62 75.74 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.823 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.8 mm? -63.79 -51.0 66.77 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.501 1.121 . . . . 0.0 112.194 172.504 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -57.48 -36.71 71.84 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.022 0.828 . . . . 0.0 113.141 175.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.32 -51.1 67.81 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -178.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.823 ' HE1' HD13 ' A' ' 40' ' ' LEU . 6.9 p-90 -73.92 -32.51 63.57 Favored 'General case' 0 CA--C 1.553 1.093 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 170.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.72 -31.16 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 O-C-N 120.584 -1.323 . . . . 0.0 112.017 173.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -55.95 -24.14 36.34 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.065 0.848 . . . . 0.0 112.384 177.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.59 -16.99 26.27 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.031 1.333 . . . . 0.0 113.28 177.288 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.703 HD11 ' CH2' ' A' ' 43' ' ' TRP . 62.8 mt . . . . . 0 N--CA 1.473 0.718 0 CA-C-N 118.669 0.668 . . . . 0.0 112.485 174.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 ppp? -60.41 -51.76 68.09 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 176.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -56.39 -35.93 68.3 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.181 0.592 . . . . 0.0 112.478 175.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.01 -51.49 46.53 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.52 0.728 . . . . 0.0 111.155 178.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.4 tttt -60.39 -49.68 76.6 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.52 0.728 . . . . 0.0 111.001 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -61.59 -51.25 69.3 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.272 1.429 . . . . 0.0 112.506 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.94 -44.18 91.36 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.634 1.106 . . . . 0.0 112.525 176.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.81 -51.14 69.48 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.832 0.853 . . . . 0.0 111.792 177.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.6 mt -54.62 -51.16 66.23 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.261 1.024 . . . . 0.0 111.104 174.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.12 -44.38 87.72 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.214 1.006 . . . . 0.0 112.66 178.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.1 tttm -58.33 -50.66 72.85 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.81 1.244 . . . . 0.0 112.0 176.052 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.62 -46.42 88.35 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.644 0.778 . . . . 0.0 112.221 178.122 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.99 -51.33 70.1 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.817 0.847 . . . . 0.0 110.831 176.273 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -54.52 -46.49 73.53 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.979 1.312 . . . . 0.0 112.815 174.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -55.65 -50.1 71.13 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.669 0.788 . . . . 0.0 112.525 175.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -68.32 -30.86 69.94 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 176.211 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 63.3 t -72.93 -24.83 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 126.376 1.87 . . . . 0.0 113.42 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.67 -30.3 65.33 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 178.003 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.2 pttt -86.82 1.08 53.55 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.331 1.453 . . . . 0.0 114.492 173.142 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.6 ttm -103.88 -159.02 0.7 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.839 2.056 . . . . 0.0 111.568 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.47 156.63 21.75 Favored Pre-proline 0 N--CA 1.479 1.019 0 C-N-CA 125.424 1.49 . . . . 0.0 113.97 177.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.43 -46.6 1.29 Allowed 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 123.843 3.029 . . . . 0.0 113.141 -176.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -61.66 -32.12 72.27 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.784 1.233 . . . . 0.0 112.924 176.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.23 -46.98 86.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 122.751 0.42 . . . . 0.0 110.445 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -55.24 -43.55 74.68 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 118.367 -0.825 . . . . 0.0 111.103 174.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? -58.47 -53.17 61.33 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.681 1.128 . . . . 0.0 112.142 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.52 -44.71 95.75 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -73.13 -39.75 65.47 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.38 -47.66 84.82 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.835 0.854 . . . . 0.0 110.532 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -51.3 -51.66 52.24 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.057 0.943 . . . . 0.0 110.941 170.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -37.37 86.07 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.543 0.611 . . . . 0.0 112.446 -179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.7 t -73.27 -43.59 60.77 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.199 -0.938 . . . . 0.0 112.885 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -46.52 73.72 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.367 0.667 . . . . 0.0 110.525 175.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.7 tp -66.65 -33.53 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 118.852 0.751 . . . . 0.0 112.018 -179.23 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.92 -31.81 72.96 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 177.161 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 . . . . . 0 N--CA 1.471 0.576 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 176.165 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.458 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.755 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -53.61 -35.07 60.49 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.553 -0.717 . . . . 0.0 112.499 -179.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -56.91 -59.52 4.93 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.006 0.522 . . . . 0.0 111.254 171.072 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.458 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -65.38 -38.07 88.93 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.313 0.506 . . . . 0.0 112.066 -175.13 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.03 -51.4 57.7 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.951 1.3 . . . . 0.0 110.459 170.458 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -57.76 -48.52 79.41 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 118.348 -0.834 . . . . 0.0 112.108 175.447 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 35.2 mm -52.72 -52.03 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.686 1.194 . . . . 0.0 111.879 177.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 38.5 mm-40 -66.61 -38.67 87.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.145 1.338 . . . . 0.0 112.547 177.497 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.85 -37.24 81.42 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.574 0.75 . . . . 0.0 112.976 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -84.53 -30.05 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.3 1.04 . . . . 0.0 113.338 172.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 84.1 t80 . . . . . 0 N--CA 1.472 0.629 0 C-N-CA 124.447 1.099 . . . . 0.0 112.788 177.361 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo . . . . . 0 CA--C 1.536 0.603 0 CA-C-O 121.314 0.464 . . . . 0.0 112.157 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -58.76 -25.91 63.5 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 174.096 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.9 m -62.43 -51.63 66.78 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.865 1.211 . . . . 0.0 111.857 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 10.2 p -70.53 -39.91 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 121.931 -0.48 . . . . 0.0 111.406 175.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -59.19 -47.24 86.05 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.381 0.672 . . . . 0.0 111.243 178.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -68.78 -44.65 73.22 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.244 1.017 . . . . 0.0 112.642 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -63.94 -33.83 76.61 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.893 -1.13 . . . . 0.0 113.076 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.0 -24.06 23.64 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.958 0.903 . . . . 0.0 113.037 177.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 . . . . . 0 N--CA 1.482 1.143 0 C-N-CA 126.189 1.795 . . . . 0.0 113.554 179.712 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo . . . . . 0 CA--C 1.545 1.053 0 N-CA-C 110.989 -0.427 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.53 -23.21 37.45 Favored 'Trans proline' 0 CA--C 1.553 1.458 0 C-N-CA 122.765 2.31 . . . . 0.0 116.768 168.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.14 167.19 24.35 Favored 'Trans proline' 0 C--N 1.361 1.227 0 CA-C-N 124.141 2.515 . . . . 0.0 113.125 175.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.418 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 40.1 Cg_endo -61.4 120.83 8.69 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.117 2.545 . . . . 0.0 111.477 172.639 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -51.25 -33.76 29.53 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.088 0.955 . . . . 0.0 111.669 171.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.455 ' CD2' HD12 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -101.3 34.09 2.68 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 127.04 2.136 . . . . 0.0 113.702 178.229 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.49 110.67 0.24 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.016 1.326 . . . . 0.0 113.37 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 145.52 11.03 0.26 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.504 1.526 . . . . 0.0 115.24 -173.224 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.45 158.19 40.63 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.964 1.706 . . . . 0.0 112.575 -171.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.83 170.19 20.62 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 123.228 2.619 . . . . 0.0 112.962 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -54.82 -37.92 66.73 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.494 1.117 . . . . 0.0 113.545 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.45 -39.75 64.7 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.321 1.448 . . . . 0.0 112.512 173.386 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.5 t -80.69 -41.79 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 124.554 1.142 . . . . 0.0 112.095 175.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.1 t -55.79 -38.97 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 118.922 0.783 . . . . 0.0 111.249 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -60.62 -50.68 72.56 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.181 -0.95 . . . . 0.0 112.266 173.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.35 -47.13 76.2 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.208 1.003 . . . . 0.0 111.529 177.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.418 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -51.79 -53.79 35.95 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.677 1.191 . . . . 0.0 111.995 169.542 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -59.07 -47.51 84.99 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.681 1.128 . . . . 0.0 113.517 -178.76 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -68.09 -30.23 69.35 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.421 0.689 . . . . 0.0 112.298 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.7 tp -69.06 -45.36 70.57 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 121.556 -0.715 . . . . 0.0 111.646 168.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.16 -45.31 95.17 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.255 1.422 . . . . 0.0 113.943 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -24.52 54.59 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 119.36 0.982 . . . . 0.0 113.547 177.352 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -75.61 -36.48 60.25 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.535 1.934 . . . . 0.0 112.632 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -109.79 20.47 18.02 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.484 1.914 . . . . 0.0 112.798 178.347 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.9 -24.53 66.06 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.028 -1.67 . . . . 0.0 112.922 -174.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.67 -1.23 30.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.069 2.148 . . . . 0.0 113.797 178.357 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -89.75 171.7 9.45 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.745 1.618 . . . . 0.0 112.13 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.56 170.33 11.98 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 126.267 1.827 . . . . 0.0 112.041 175.314 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -45.45 -62.34 1.8 Allowed Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.501 1.52 . . . . 0.0 112.969 172.32 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.35 -35.26 24.43 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.034 1.823 . . . . 0.0 114.022 -179.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -60.57 -44.96 95.59 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.116 -0.99 . . . . 0.0 112.234 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 61.6 mt -70.95 -47.75 60.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 118.74 -0.648 . . . . 0.0 111.162 175.293 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -52.38 -38.75 59.67 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.023 0.829 . . . . 0.0 110.902 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -51.0 71.21 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.671 1.588 . . . . 0.0 112.394 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.64 -38.49 89.51 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.162 0.585 . . . . 0.0 111.901 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.675 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.1 mm? -62.91 -51.09 68.29 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.459 1.103 . . . . 0.0 110.988 173.538 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -59.75 -34.0 72.39 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.283 1.033 . . . . 0.0 113.621 176.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.3 -52.24 66.42 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.717 -0.614 . . . . 0.0 112.57 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.683 ' CH2' HD11 ' A' ' 47' ' ' LEU . 10.7 p-90 -73.74 -29.85 62.47 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 172.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.409 HG23 HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -60.64 -32.18 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 O-C-N 120.789 -1.194 . . . . 0.0 112.65 174.205 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -58.1 -17.82 20.76 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 175.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.57 -11.89 18.9 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.801 1.24 . . . . 0.0 113.385 177.59 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.683 HD11 ' CH2' ' A' ' 43' ' ' TRP . 19.9 mt . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 175.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -61.93 -53.27 58.06 Favored 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 123.737 0.815 . . . . 0.0 112.258 176.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -55.13 -36.15 65.45 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.122 0.569 . . . . 0.0 111.894 176.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.81 -51.51 40.02 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.008 0.923 . . . . 0.0 111.509 179.081 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.7 mttm -59.27 -49.39 78.01 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.338 1.055 . . . . 0.0 111.591 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.35 -54.11 50.54 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.259 1.423 . . . . 0.0 112.096 177.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.3 -44.63 96.9 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.572 1.078 . . . . 0.0 112.841 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -67.66 -45.45 75.25 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.616 -0.678 . . . . 0.0 112.389 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.49 -51.14 67.97 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.002 0.921 . . . . 0.0 110.565 170.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.02 -43.91 91.66 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.293 0.637 . . . . 0.0 112.247 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -56.74 -50.73 71.36 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.795 1.18 . . . . 0.0 112.161 174.037 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.12 -47.55 82.31 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.14 0.576 . . . . 0.0 112.194 179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.465 ' O ' HG23 ' A' ' 77' ' ' VAL . 1.1 t-80 -56.79 -49.93 73.85 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.919 1.288 . . . . 0.0 110.744 174.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -52.67 -48.6 66.41 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.92 1.688 . . . . 0.0 111.51 177.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -56.93 -49.5 75.45 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.895 1.278 . . . . 0.0 112.654 176.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.79 -30.84 71.54 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.923 1.082 . . . . 0.0 113.923 172.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 73' ' ' HIS . 96.4 t -72.99 -24.43 20.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.967 1.307 . . . . 0.0 112.675 176.223 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.416 ' HB2' ' HE2' ' A' ' 85' ' ' LYS . . . -56.89 -28.73 62.24 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 176.454 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -89.82 1.41 56.19 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.156 1.382 . . . . 0.0 114.573 173.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.4 ttm -105.35 -161.62 0.82 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.795 2.038 . . . . 0.0 111.643 -172.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.9 155.66 22.43 Favored Pre-proline 0 N--CA 1.479 1.01 0 C-N-CA 124.622 1.169 . . . . 0.0 113.536 177.128 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.46 -42.6 3.56 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 123.387 2.725 . . . . 0.0 112.42 -178.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -63.55 -34.71 78.39 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.308 -0.87 . . . . 0.0 112.645 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.4 -41.28 93.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.744 0.818 . . . . 0.0 110.198 175.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.416 ' HE2' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -55.34 -48.05 74.78 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.89 174.907 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -59.4 -52.45 65.57 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.205 1.002 . . . . 0.0 111.629 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.9 -48.69 80.68 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 177.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -70.56 -42.4 71.19 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.447 -0.783 . . . . 0.0 112.512 -176.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.92 -43.4 98.92 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.083 -1.011 . . . . 0.0 112.2 173.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -54.92 -50.09 69.66 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.481 1.112 . . . . 0.0 111.471 171.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.4 tp -59.7 -37.74 79.69 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 173.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.6 t -73.23 -40.27 64.81 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.59 -1.319 . . . . 0.0 112.923 -177.177 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.5 ptpm? -69.21 -43.41 74.16 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.847 -0.597 . . . . 0.0 110.779 175.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.4 tt -70.03 -33.18 54.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 119.141 0.882 . . . . 0.0 112.341 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.71 69.48 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.289 1.036 . . . . 0.0 113.426 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.542 0.641 0 C-N-CA 125.303 1.441 . . . . 0.0 113.442 179.398 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.528 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.48 1.044 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.52 -35.3 39.97 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.692 0.797 . . . . 0.0 112.979 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -59.42 -59.36 5.58 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-O 118.967 -0.539 . . . . 0.0 111.588 171.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.528 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.16 -36.32 83.68 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.039 0.836 . . . . 0.0 112.707 -175.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.8 tm0? -51.72 -54.59 26.67 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.139 1.376 . . . . 0.0 110.791 167.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -57.52 -50.68 72.28 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 117.97 -1.014 . . . . 0.0 112.497 176.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 30.8 mm -52.17 -48.67 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.757 1.223 . . . . 0.0 111.556 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -67.51 -44.22 78.95 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.416 -0.803 . . . . 0.0 112.744 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.8 -37.84 83.34 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.084 0.953 . . . . 0.0 112.819 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -79.34 -34.24 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.021 0.928 . . . . 0.0 112.472 170.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 64.6 t80 . . . . . 0 N--CA 1.473 0.687 0 CA-C-N 119.957 1.253 . . . . 0.0 113.342 177.965 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo . . . . . 0 CA--C 1.533 0.458 0 CA-C-O 121.811 0.671 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -59.24 -24.88 63.56 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 12.7 t -63.0 -51.74 65.69 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.338 0.972 . . . . 0.0 111.875 175.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.7 p -72.89 -39.28 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 O-C-N 121.857 -0.527 . . . . 0.0 111.353 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -57.38 -50.18 73.81 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.11 0.868 . . . . 0.0 111.734 173.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -66.03 -43.43 87.6 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.934 1.243 . . . . 0.0 112.126 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -63.46 -33.63 75.99 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 120.57 -1.331 . . . . 0.0 113.067 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.22 -22.69 22.63 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.208 1.003 . . . . 0.0 113.151 178.124 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 . . . . . 0 N--CA 1.483 1.216 0 C-N-CA 126.865 2.066 . . . . 0.0 114.137 177.848 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo . . . . . 0 CA--C 1.545 1.055 0 CA-C-O 119.098 -0.459 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -70.44 -22.59 28.76 Favored 'Trans proline' 0 CA--C 1.554 1.478 0 C-N-CA 122.041 1.827 . . . . 0.0 116.279 166.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -70.19 167.75 24.09 Favored 'Trans proline' 0 C--N 1.363 1.3 0 CA-C-N 124.078 2.492 . . . . 0.0 112.913 179.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -61.37 126.77 20.07 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.934 2.423 . . . . 0.0 110.467 172.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -56.73 -43.43 80.65 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 122.062 -0.399 . . . . 0.0 110.644 173.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.468 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.0 pt? -72.59 16.09 0.16 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 126.778 2.031 . . . . 0.0 116.453 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.34 106.71 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.804 2.041 . . . . 0.0 114.724 -174.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.87 30.59 0.17 Allowed Glycine 0 CA--C 1.537 1.458 0 C-N-CA 124.885 1.231 . . . . 0.0 114.837 -172.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -124.72 157.5 65.71 Favored Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 125.487 1.515 . . . . 0.0 111.925 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.412 ' O ' HG23 ' A' ' 18' ' ' VAL . 77.4 Cg_endo -73.18 168.15 25.48 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.304 2.669 . . . . 0.0 112.858 -179.383 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -52.9 -37.47 60.66 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.667 1.187 . . . . 0.0 113.224 -178.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -57.92 -37.97 75.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.13 1.372 . . . . 0.0 112.643 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 84.6 t -80.12 -40.37 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.116 1.366 . . . . 0.0 111.481 173.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 14' ' ' PRO . 32.2 t -57.02 -37.31 54.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.493 0.717 . . . . 0.0 111.15 178.038 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.9 tppt? -59.26 -50.18 75.0 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 120.545 -1.347 . . . . 0.0 112.223 174.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.15 -46.92 87.12 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.434 0.693 . . . . 0.0 111.263 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -51.97 60.24 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.145 0.978 . . . . 0.0 112.154 170.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -59.56 -47.49 85.36 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.609 1.095 . . . . 0.0 112.789 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -63.92 -37.04 85.93 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.583 0.753 . . . . 0.0 111.932 177.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.7 tp -66.38 -43.92 84.59 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.406 0.682 . . . . 0.0 112.166 173.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.71 -49.1 69.72 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.927 1.291 . . . . 0.0 113.543 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.3 pttt -56.31 -30.75 62.94 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.234 0.925 . . . . 0.0 113.017 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -65.92 -40.65 91.62 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.739 2.016 . . . . 0.0 112.345 174.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -109.73 28.28 8.72 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.568 1.947 . . . . 0.0 112.671 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -66.62 -24.65 66.34 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 119.888 -1.757 . . . . 0.0 112.374 -175.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.7 p -80.22 4.24 18.19 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 127.729 2.411 . . . . 0.0 114.361 177.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -87.51 170.92 10.92 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.431 1.492 . . . . 0.0 112.167 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.82 172.17 8.51 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.851 2.061 . . . . 0.0 111.643 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -51.16 -58.65 9.75 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.063 1.345 . . . . 0.0 112.591 176.018 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -68.67 -32.04 24.79 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 121.436 1.424 . . . . 0.0 113.128 178.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -65.89 -46.76 77.18 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 121.03 -1.044 . . . . 0.0 112.547 178.389 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 90.3 mt -65.66 -53.43 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 123.216 0.606 . . . . 0.0 109.555 175.003 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.09 -36.68 77.93 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 118.122 0.419 . . . . 0.0 112.007 -173.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.4 tttm -57.06 -57.07 14.17 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 126.008 1.723 . . . . 0.0 112.695 171.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -60.82 -40.43 92.71 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 122.871 0.468 . . . . 0.0 111.835 -177.682 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.725 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.1 mm? -59.01 -51.11 71.47 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.12 0.968 . . . . 0.0 111.101 171.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -62.93 -31.76 72.91 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.29 -52.01 67.08 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.58 0.752 . . . . 0.0 112.372 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.725 ' HE1' HD13 ' A' ' 40' ' ' LEU . 10.6 p-90 -73.29 -30.97 63.77 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 172.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.413 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -59.13 -31.76 46.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.072 1.349 . . . . 0.0 112.596 174.023 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -57.83 -21.41 42.23 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 118.717 0.689 . . . . 0.0 112.716 174.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.38 -16.99 22.97 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.35 1.06 . . . . 0.0 112.941 178.3 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.647 HD11 ' CH2' ' A' ' 43' ' ' TRP . 22.8 mt . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 178.004 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.9 tmm? -64.31 -51.74 61.97 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 123.982 0.913 . . . . 0.0 112.537 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 23.5 mttm -54.49 -34.99 62.63 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.22 -51.55 30.0 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.943 0.792 . . . . 0.0 111.722 178.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.8 -50.06 75.38 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.093 0.957 . . . . 0.0 110.832 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.07 -51.08 70.69 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.151 1.38 . . . . 0.0 112.133 178.218 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.8 -50.39 72.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 120.166 1.348 . . . . 0.0 112.555 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.67 -50.73 71.31 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.705 0.802 . . . . 0.0 112.475 178.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.1 tp -55.07 -49.65 71.11 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.213 1.405 . . . . 0.0 111.258 175.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.78 -44.16 97.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.825 1.25 . . . . 0.0 111.592 178.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.0 tttp -57.52 -50.22 73.8 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.773 1.17 . . . . 0.0 111.983 175.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.31 -49.7 74.59 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.662 0.785 . . . . 0.0 112.751 176.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.4 m80 -54.76 -50.84 67.44 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.635 0.774 . . . . 0.0 111.572 173.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -53.7 -47.92 70.04 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.836 1.654 . . . . 0.0 112.887 176.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.17 -48.43 73.77 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.014 0.926 . . . . 0.0 112.122 174.113 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.04 77.78 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 50.3 t -69.6 -26.03 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 126.167 1.787 . . . . 0.0 112.365 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.22 -31.78 44.92 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 173.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.3 pttt -93.2 -1.19 56.49 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 176.389 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -90.85 -81.37 0.31 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.425 1.09 . . . . 0.0 110.711 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.64 153.71 80.79 Favored Pre-proline 0 N--CA 1.481 1.078 0 C-N-CA 126.96 2.104 . . . . 0.0 113.273 -173.435 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.59 -48.24 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.828 3.018 . . . . 0.0 113.191 -178.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -66.73 -34.41 77.77 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.284 1.034 . . . . 0.0 112.389 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.71 -34.62 78.62 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.568 0.747 . . . . 0.0 111.921 178.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.33 -53.31 52.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 118.996 0.816 . . . . 0.0 109.837 170.034 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.1 mttt -59.84 -47.39 85.91 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.358 0.663 . . . . 0.0 111.053 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.63 -54.46 46.22 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.431 1.092 . . . . 0.0 113.43 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.41 -35.73 79.86 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.2 -0.937 . . . . 0.0 112.488 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.45 -45.78 71.57 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 121.473 -0.767 . . . . 0.0 110.941 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -52.62 -51.96 57.63 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.193 0.997 . . . . 0.0 111.261 168.261 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 7.0 tp -58.65 -37.18 75.41 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 119.286 0.948 . . . . 0.0 112.042 177.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.7 t -70.18 -48.23 58.11 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.066 -1.021 . . . . 0.0 112.581 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 ptpt -69.5 -36.28 76.33 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.789 0.836 . . . . 0.0 111.671 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.2 tp -72.34 -32.04 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 118.629 0.649 . . . . 0.0 111.77 176.342 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.27 -21.54 65.29 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 -177.264 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.886 0 C-N-CA 125.708 1.603 . . . . 0.0 113.236 176.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.559 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.041 0 CA-C-O 121.775 0.797 . . . . 0.0 112.884 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.91 -35.35 6.36 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.35 1.06 . . . . 0.0 112.738 174.455 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.8 pttt -57.35 -53.48 57.63 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.356 1.462 . . . . 0.0 112.494 171.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.559 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -69.03 -33.77 74.15 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 120.294 1.406 . . . . 0.0 111.895 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -59.09 -54.7 44.07 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 173.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.0 pttm -59.38 -42.77 92.45 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.529 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.5 mm -55.72 -48.52 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.325 1.05 . . . . 0.0 111.256 175.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -62.3 -45.35 93.66 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.237 1.381 . . . . 0.0 112.609 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.22 -35.47 81.16 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.584 0.754 . . . . 0.0 112.525 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.3 pt -79.31 -36.29 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 118.737 0.699 . . . . 0.0 112.208 170.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 55.6 t80 . . . . . 0 N--CA 1.473 0.701 0 C-N-CA 125.278 1.431 . . . . 0.0 112.024 179.281 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo . . . . . 0 CA--C 1.534 0.481 0 CA-C-O 121.093 0.372 . . . . 0.0 111.688 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -58.47 -25.54 62.39 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.608 -0.682 . . . . 0.0 112.801 175.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.7 m -61.56 -51.61 67.87 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.38 1.445 . . . . 0.0 112.197 177.326 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 9.4 p -75.3 -38.77 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.752 -0.593 . . . . 0.0 111.793 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -57.69 -48.33 79.83 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 118.911 0.778 . . . . 0.0 111.999 172.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.68 -39.55 73.47 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.511 1.05 . . . . 0.0 112.806 178.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -66.31 -34.81 78.83 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.675 1.125 . . . . 0.0 112.442 177.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.65 -21.55 25.22 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.108 0.963 . . . . 0.0 113.219 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 . . . . . 0 N--CA 1.48 1.051 0 C-N-CA 125.657 1.583 . . . . 0.0 113.864 179.184 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo . . . . . 0 CA--C 1.543 0.975 0 CA-C-O 119.165 -0.431 . . . . 0.0 111.731 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.25 -21.98 26.13 Favored 'Trans proline' 0 CA--C 1.554 1.478 0 C-N-CA 122.171 1.914 . . . . 0.0 116.5 167.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -70.28 166.53 27.92 Favored 'Trans proline' 0 C--N 1.362 1.268 0 CA-C-N 124.25 2.554 . . . . 0.0 112.873 178.563 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.31 126.86 19.49 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.814 2.343 . . . . 0.0 110.418 173.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -60.31 -33.81 72.9 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 119.807 -0.757 . . . . 0.0 111.419 174.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.458 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.6 pt? -77.91 17.26 0.6 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.33 2.252 . . . . 0.0 115.902 172.709 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -38.49 105.37 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.029 1.731 . . . . 0.0 114.922 -173.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 147.69 24.17 0.08 OUTLIER Glycine 0 CA--C 1.539 1.581 0 C-N-CA 124.864 1.221 . . . . 0.0 115.296 -172.046 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.96 158.97 46.53 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 125.098 1.359 . . . . 0.0 112.542 -173.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.415 ' O ' HG23 ' A' ' 18' ' ' VAL . 88.5 Cg_endo -73.46 167.29 27.67 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.196 2.598 . . . . 0.0 112.755 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -50.99 -40.7 58.57 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.503 1.521 . . . . 0.0 113.264 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -56.93 -37.48 71.55 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.48 1.512 . . . . 0.0 113.058 176.057 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.0 t -81.77 -41.11 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 125.0 1.32 . . . . 0.0 111.634 174.654 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 14' ' ' PRO . 39.6 t -57.5 -36.94 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 123.956 0.902 . . . . 0.0 111.34 178.166 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.5 tptt -64.03 -43.22 96.26 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 172.3 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.77 -45.42 94.4 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.347 0.659 . . . . 0.0 110.54 175.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.76 -46.29 84.75 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-O 117.475 -1.25 . . . . 0.0 113.646 171.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.56 -47.02 83.26 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 120.192 1.36 . . . . 0.0 112.739 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.34 -38.25 88.78 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.02 0.928 . . . . 0.0 111.621 177.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.0 tp -63.89 -46.97 82.5 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 122.898 0.479 . . . . 0.0 111.46 171.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.44 -45.76 92.5 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.117 1.367 . . . . 0.0 114.443 -178.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -58.41 -28.26 65.05 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.664 1.12 . . . . 0.0 113.608 175.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -76.28 -32.61 58.9 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.503 1.521 . . . . 0.0 113.59 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -108.08 19.6 19.77 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.368 1.467 . . . . 0.0 114.197 176.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -57.79 -28.79 64.32 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 119.948 -1.72 . . . . 0.0 113.247 -177.078 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.7 m -77.18 -2.27 33.62 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.379 1.872 . . . . 0.0 113.767 179.098 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -83.21 167.28 17.85 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.381 1.472 . . . . 0.0 112.613 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.0 172.78 9.31 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 126.556 1.942 . . . . 0.0 112.213 177.824 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -50.77 -59.89 6.55 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 126.159 1.784 . . . . 0.0 112.913 175.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.8 -32.65 29.17 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.636 1.558 . . . . 0.0 112.974 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.65 -49.98 71.09 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.05 -1.032 . . . . 0.0 112.517 177.183 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 94.1 mt -61.93 -53.53 46.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 123.215 0.606 . . . . 0.0 110.228 174.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -58.52 -40.36 82.7 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 118.319 0.509 . . . . 0.0 112.342 -174.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.31 -54.22 49.22 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.412 1.885 . . . . 0.0 112.479 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.96 -41.12 97.63 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.404 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.738 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.9 mm? -59.36 -51.07 71.48 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 124.007 0.923 . . . . 0.0 113.033 171.735 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.61 -36.06 79.65 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 176.264 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.52 -50.33 73.42 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.159 0.89 . . . . 0.0 112.231 -177.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.738 ' HE1' HD13 ' A' ' 40' ' ' LEU 0.268 8.5 p-90 -69.24 -36.99 77.74 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 170.982 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.425 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -58.2 -31.19 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 125.109 1.364 . . . . 0.0 113.62 176.961 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -57.24 -17.66 12.6 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 175.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.35 -15.47 20.71 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.178 1.391 . . . . 0.0 113.689 176.058 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.677 HD11 ' CH2' ' A' ' 43' ' ' TRP . 32.6 mt . . . . . 0 N--CA 1.474 0.76 0 CA-C-N 118.899 0.772 . . . . 0.0 112.869 175.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.471 0.61 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -65.03 -51.57 60.82 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.608 1.163 . . . . 0.0 112.348 177.519 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 22.0 mtmt -54.97 -34.06 62.98 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.994 0.815 . . . . 0.0 112.668 172.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.39 -48.31 50.7 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 119.693 1.133 . . . . 0.0 111.767 178.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.45 -52.27 65.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.013 0.925 . . . . 0.0 110.66 177.097 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.01 -49.89 76.18 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.873 1.269 . . . . 0.0 112.259 178.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.1 -45.45 94.65 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.339 0.972 . . . . 0.0 112.014 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -63.43 -49.78 72.36 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 118.762 0.71 . . . . 0.0 111.674 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.8 mt -56.27 -50.02 72.55 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.045 1.338 . . . . 0.0 111.36 174.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -64.08 -41.68 97.22 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 118.569 -0.729 . . . . 0.0 112.249 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -59.2 -50.61 73.35 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.792 1.178 . . . . 0.0 111.719 176.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.79 -50.07 73.82 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.119 0.967 . . . . 0.0 113.091 175.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -57.05 -52.31 65.78 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 118.716 -0.659 . . . . 0.0 111.515 174.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -55.12 -44.16 74.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.537 1.535 . . . . 0.0 112.908 177.06 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.59 -52.32 64.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.246 1.019 . . . . 0.0 112.709 172.286 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.2 -33.34 75.17 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.534 0.606 . . . . 0.0 112.505 177.102 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 56.0 t -72.65 -25.46 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.242 1.817 . . . . 0.0 112.301 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.45 -33.02 58.78 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 175.406 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.4 pttt -90.25 -0.69 57.74 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.511 1.524 . . . . 0.0 114.289 173.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 tpp -95.26 -159.22 0.7 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.612 1.965 . . . . 0.0 111.89 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.38 156.84 20.09 Favored Pre-proline 0 N--CA 1.478 0.953 0 C-N-CA 126.313 1.845 . . . . 0.0 114.334 176.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -71.75 -43.04 1.42 Allowed 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.85 3.034 . . . . 0.0 113.537 -175.684 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -58.98 -36.59 75.13 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.668 1.187 . . . . 0.0 111.765 174.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.86 -42.47 90.38 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.488 0.715 . . . . 0.0 110.321 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.91 -46.45 71.44 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.302 1.041 . . . . 0.0 111.799 173.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -62.97 -51.95 64.88 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.509 1.123 . . . . 0.0 112.083 178.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.07 -55.66 30.22 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.47 0.708 . . . . 0.0 112.02 176.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.75 -31.17 71.64 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.98 77.1 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.751 1.16 . . . . 0.0 111.275 171.162 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -42.59 94.63 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 174.428 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.412 ' HA ' HG22 ' A' ' 94' ' ' ILE . 3.4 mm? -63.97 -39.41 94.06 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 118.979 0.808 . . . . 0.0 113.121 174.273 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.0 t -71.6 -39.59 70.42 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 120.952 -1.092 . . . . 0.0 111.856 -177.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.04 -37.57 64.26 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 118.831 -0.604 . . . . 0.0 112.17 176.478 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.412 HG22 ' HA ' ' A' ' 91' ' ' LEU . 10.4 tt -72.99 -32.25 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 119.133 0.879 . . . . 0.0 112.972 177.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.78 -22.69 64.35 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 . . . . . 0 CA--C 1.551 1.017 0 C-N-CA 125.142 1.377 . . . . 0.0 113.613 173.268 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.471 0.59 0 CA-C-O 121.044 0.449 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -55.66 -37.62 68.5 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.775 1.23 . . . . 0.0 113.009 -174.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -61.25 -58.7 7.23 Favored 'General case' 0 C--N 1.346 0.45 0 C-N-CA 124.627 1.171 . . . . 0.0 112.428 170.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.96 77.62 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.057 1.343 . . . . 0.0 113.312 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -56.6 -52.19 65.8 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.091 1.356 . . . . 0.0 111.527 168.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.88 -48.04 64.26 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 118.791 -0.624 . . . . 0.0 111.675 173.552 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.1 mm -58.31 -52.22 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 118.849 0.749 . . . . 0.0 111.407 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -63.57 -36.98 85.58 Favored 'General case' 0 C--O 1.242 0.683 0 O-C-N 121.501 -0.749 . . . . 0.0 112.782 178.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.64 -41.54 83.69 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.312 -1.328 . . . . 0.0 113.016 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.4 pt -75.14 -33.31 28.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 O-C-N 121.464 -0.773 . . . . 0.0 110.95 177.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.3 t80 . . . . . 0 CA--C 1.534 0.33 0 O-C-N 121.235 -0.915 . . . . 0.0 111.598 176.675 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo . . . . . 0 CA--C 1.535 0.558 0 CA-C-O 121.975 0.74 . . . . 0.0 112.608 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -22.04 66.86 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.539 -0.726 . . . . 0.0 112.523 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 49.9 m -64.91 -48.62 73.51 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 173.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.1 p -74.88 -37.16 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 119.002 0.819 . . . . 0.0 110.485 177.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -57.6 -50.41 73.22 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.963 0.801 . . . . 0.0 111.991 171.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -63.23 -44.0 96.51 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.49 1.041 . . . . 0.0 112.996 178.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -66.59 -32.83 74.41 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.482 -0.761 . . . . 0.0 112.714 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.92 -22.79 21.81 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.192 0.997 . . . . 0.0 113.682 178.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 . . . . . 0 N--CA 1.475 0.8 0 C-N-CA 125.719 1.608 . . . . 0.0 111.953 176.245 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo . . . . . 0 CA--C 1.545 1.035 0 CA-C-O 119.118 -0.451 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -70.39 -23.47 27.89 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 CA-C-O 115.292 -2.045 . . . . 0.0 115.927 164.443 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -72.3 167.72 26.14 Favored 'Trans proline' 0 C--N 1.362 1.282 0 CA-C-N 124.596 2.677 . . . . 0.0 113.017 179.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -63.35 127.2 19.42 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.991 2.461 . . . . 0.0 112.053 177.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -62.32 -14.78 43.03 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 172.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.432 HD13 ' N ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -118.96 36.01 4.61 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 129.029 2.932 . . . . 0.0 112.409 177.236 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.89 109.82 0.19 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.682 1.593 . . . . 0.0 113.123 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.23 -19.4 1.37 Allowed Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.749 1.643 . . . . 0.0 114.069 -176.488 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.9 160.9 81.37 Favored Pre-proline 0 CA--C 1.558 1.276 0 C-N-CA 125.646 1.578 . . . . 0.0 113.753 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -75.68 171.54 18.0 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.921 3.081 . . . . 0.0 113.669 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -53.38 -35.17 60.04 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.619 1.168 . . . . 0.0 113.944 -178.544 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -54.35 -42.1 69.87 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.51 1.524 . . . . 0.0 112.068 174.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -77.81 -43.0 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 125.355 1.462 . . . . 0.0 112.099 173.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 88.3 t -55.29 -36.82 41.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 118.806 0.73 . . . . 0.0 111.352 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.7 tptm -62.96 -50.49 70.58 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.987 -1.071 . . . . 0.0 112.24 172.226 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.03 -48.34 73.54 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.467 0.707 . . . . 0.0 111.798 177.08 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -53.58 -52.42 59.81 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.738 1.215 . . . . 0.0 112.149 171.319 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -60.04 -47.51 85.56 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.571 1.078 . . . . 0.0 113.076 -179.301 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -63.71 -36.34 83.55 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.676 0.79 . . . . 0.0 111.732 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.7 tp -66.25 -46.06 78.41 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.372 0.669 . . . . 0.0 111.829 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -63.49 -45.97 88.29 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.843 1.257 . . . . 0.0 114.024 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -33.53 70.92 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 120.048 1.295 . . . . 0.0 113.461 177.727 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -69.1 -33.41 73.46 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.396 1.878 . . . . 0.0 112.95 173.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -107.04 20.34 19.17 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.019 2.128 . . . . 0.0 112.895 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -64.4 -25.51 68.05 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 119.775 -1.828 . . . . 0.0 112.762 -174.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.3 -5.01 59.0 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 127.142 2.177 . . . . 0.0 113.335 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.2 mmtt -76.09 -177.71 4.07 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.332 1.453 . . . . 0.0 112.906 178.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.77 172.77 6.67 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 128.082 2.553 . . . . 0.0 111.705 -177.71 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -49.96 -59.83 6.23 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 125.28 1.432 . . . . 0.0 112.426 176.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.45 -32.91 18.89 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 121.613 1.542 . . . . 0.0 113.261 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.48 -48.06 81.25 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.063 -1.023 . . . . 0.0 111.955 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 54.2 mt -66.1 -52.27 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.278 0.631 . . . . 0.0 110.02 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -57.08 -41.12 78.26 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.69 0.677 . . . . 0.0 111.814 -177.064 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -52.35 65.98 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.294 1.438 . . . . 0.0 112.917 174.262 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -62.25 -42.47 99.35 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.638 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.0 mm? -60.1 -49.73 76.49 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.295 1.038 . . . . 0.0 110.979 173.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.8 -35.44 76.5 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 176.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.73 -49.36 76.81 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.447 -0.783 . . . . 0.0 112.339 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.638 ' HE1' HD13 ' A' ' 40' ' ' LEU . 9.9 p-90 -73.17 -32.94 65.15 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 172.074 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -58.39 -30.68 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 125.507 1.523 . . . . 0.0 112.987 174.274 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.84 -19.28 16.57 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 118.803 0.729 . . . . 0.0 112.907 174.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.27 -18.54 22.36 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.799 1.24 . . . . 0.0 113.795 175.178 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.61 HD11 ' CH2' ' A' ' 43' ' ' TRP . 33.0 mt . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 178.236 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.76 -51.5 66.9 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.653 1.181 . . . . 0.0 111.905 177.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.5 mtmm -57.86 -33.6 68.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.46 -50.15 34.44 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.037 0.835 . . . . 0.0 111.444 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 tttm -57.15 -49.73 75.02 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.654 0.782 . . . . 0.0 110.396 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -62.19 -52.0 65.53 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.72 1.208 . . . . 0.0 112.23 179.413 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.66 -46.27 90.47 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.803 1.183 . . . . 0.0 112.859 178.418 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -61.75 -50.16 73.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.527 1.131 . . . . 0.0 111.398 178.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tt -56.7 -51.16 69.86 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.467 1.107 . . . . 0.0 110.685 174.451 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.38 -40.86 97.85 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.982 -178.27 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.1 tttt -59.01 -50.86 72.5 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.384 0.993 . . . . 0.0 111.379 173.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.33 -44.87 86.43 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.268 0.556 . . . . 0.0 111.548 -176.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -60.53 -49.36 77.86 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.798 1.239 . . . . 0.0 110.94 175.484 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.03 -43.21 86.65 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.647 1.112 . . . . 0.0 112.843 175.392 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -55.14 -52.57 62.86 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.43 1.092 . . . . 0.0 112.445 173.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.51 -31.27 71.89 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 175.747 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.4 t -73.05 -23.76 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.678 1.591 . . . . 0.0 113.382 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.63 -30.77 67.54 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.695 1.369 . . . . 0.0 114.695 177.131 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -86.09 -2.65 58.52 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.516 1.526 . . . . 0.0 114.219 172.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.9 tpp -96.86 -160.41 0.8 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.407 1.883 . . . . 0.0 111.833 -174.484 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.89 156.64 18.14 Favored Pre-proline 0 N--CA 1.478 0.971 0 C-N-CA 126.735 2.014 . . . . 0.0 113.984 174.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.79 -48.32 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 123.599 2.866 . . . . 0.0 112.858 -176.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -57.13 -32.96 66.89 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.034 1.334 . . . . 0.0 112.269 177.086 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.22 -48.79 74.49 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.474 0.709 . . . . 0.0 110.596 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -54.87 -45.5 74.62 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.713 0.688 . . . . 0.0 111.235 173.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? -54.99 -54.91 36.86 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 118.867 0.758 . . . . 0.0 111.241 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.54 -51.93 67.74 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.956 0.903 . . . . 0.0 113.15 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.4 -40.5 95.93 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -178.629 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.19 -45.11 94.84 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.481 0.712 . . . . 0.0 110.93 174.72 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -43.88 90.67 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.399 0.545 . . . . 0.0 112.374 172.646 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.63 -36.96 84.5 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 174.439 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 10.3 t -70.67 -42.41 70.77 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.406 1.082 . . . . 0.0 112.987 -178.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -70.5 -44.01 68.51 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.521 -0.737 . . . . 0.0 111.133 175.564 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.8 tt -68.26 -30.63 48.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 118.697 0.681 . . . . 0.0 112.371 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.06 -33.69 69.31 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 176.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 . . . . . 0 CA--C 1.542 0.648 0 C-N-CA 124.087 0.955 . . . . 0.0 113.412 173.291 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.535 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -44.94 -38.45 4.69 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.761 1.224 . . . . 0.0 112.994 172.219 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -63.99 -59.38 4.56 Favored 'General case' 0 C--N 1.345 0.394 0 C-N-CA 123.571 0.748 . . . . 0.0 111.031 174.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.535 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -63.16 -33.32 75.22 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.994 0.816 . . . . 0.0 113.071 -178.008 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.74 -53.73 53.04 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.688 1.595 . . . . 0.0 110.805 168.645 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -58.12 -48.12 81.19 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.044 0.937 . . . . 0.0 112.527 175.313 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 26.9 mm -54.05 -52.05 40.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.666 0.786 . . . . 0.0 110.562 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -66.62 -40.97 89.01 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 118.688 -0.672 . . . . 0.0 112.392 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.82 -40.36 94.99 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.566 1.075 . . . . 0.0 111.122 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 53.3 mt -75.86 -51.76 19.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 C-N-CA 123.983 0.913 . . . . 0.0 110.978 176.496 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.7 t80 . . . . . 0 N--CA 1.47 0.568 0 CA-C-N 118.879 0.763 . . . . 0.0 112.726 179.4 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo . . . . . 0 CA--C 1.537 0.643 0 CA-C-O 121.966 0.736 . . . . 0.0 113.01 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.04 -24.49 67.73 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.242 -0.911 . . . . 0.0 112.784 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.5 m -60.94 -51.54 68.85 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.248 0.931 . . . . 0.0 112.145 173.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.57 -37.34 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-N 118.529 0.604 . . . . 0.0 111.573 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.2 mtmp? -58.01 -49.89 75.31 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.794 -0.622 . . . . 0.0 111.972 172.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -64.33 -45.08 89.42 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.091 0.86 . . . . 0.0 112.891 177.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -65.63 -32.03 73.38 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.692 0.678 . . . . 0.0 112.744 -179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.19 -21.57 21.07 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 178.623 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 . . . . . 0 N--CA 1.475 0.784 0 C-N-CA 124.875 1.27 . . . . 0.0 112.521 179.238 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo . . . . . 0 CA--C 1.548 1.193 0 CA-C-O 118.965 -0.514 . . . . 0.0 111.663 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -71.65 -19.78 27.51 Favored 'Trans proline' 0 CA--C 1.554 1.486 0 C-N-CA 122.099 1.866 . . . . 0.0 116.11 164.345 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.48 169.43 20.93 Favored 'Trans proline' 0 C--N 1.362 1.281 0 CA-C-N 124.272 2.561 . . . . 0.0 112.729 177.296 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -60.1 122.31 11.18 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.858 2.372 . . . . 0.0 110.75 171.665 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -53.4 -32.62 50.38 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.054 0.542 . . . . 0.0 111.949 172.025 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.561 HD13 ' H ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -103.12 38.9 1.66 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 128.312 2.645 . . . . 0.0 113.138 176.859 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.72 112.92 0.48 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.808 1.243 . . . . 0.0 113.296 176.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.5 11.06 0.32 Allowed Glycine 0 CA--C 1.538 1.474 0 C-N-CA 125.296 1.427 . . . . 0.0 115.634 -176.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -111.27 159.8 31.55 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 125.645 1.578 . . . . 0.0 112.846 -171.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -73.53 169.74 21.6 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.298 2.665 . . . . 0.0 113.085 178.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -52.53 -35.19 52.83 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.553 1.141 . . . . 0.0 113.659 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -56.38 -39.07 72.34 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.205 1.402 . . . . 0.0 112.802 174.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.404 HG13 ' HH2' ' A' ' 43' ' ' TRP . 54.5 t -77.91 -44.83 28.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.595 1.158 . . . . 0.0 111.792 171.431 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 94.2 t -54.22 -37.53 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 123.366 0.667 . . . . 0.0 111.468 -178.2 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.7 tppt? -59.91 -50.57 73.25 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.363 -0.836 . . . . 0.0 112.376 174.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.95 -47.97 83.17 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.044 0.938 . . . . 0.0 111.728 177.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.464 ' CD1' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -53.79 -53.67 49.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.665 0.786 . . . . 0.0 111.433 172.609 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -63.19 -45.1 93.31 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.445 1.02 . . . . 0.0 113.138 -179.183 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -59.74 -39.17 83.88 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.231 1.013 . . . . 0.0 111.555 177.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.492 HD23 HD22 ' A' ' 40' ' ' LEU . 12.9 tp -68.31 -45.8 71.99 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.148 0.579 . . . . 0.0 111.577 172.599 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.548 HD12 HD21 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -64.2 -45.73 87.0 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 179.759 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -56.88 -31.62 65.03 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 119.649 1.113 . . . . 0.0 112.431 178.191 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -73.65 -29.34 62.27 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.025 1.33 . . . . 0.0 111.744 175.786 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -109.81 23.7 14.03 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.045 1.738 . . . . 0.0 112.549 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -22.09 66.57 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 119.904 -1.747 . . . . 0.0 113.687 -175.502 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.0 p -92.88 4.11 54.48 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 128.803 2.841 . . . . 0.0 114.307 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -85.75 179.9 6.97 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.329 1.452 . . . . 0.0 111.858 178.048 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.22 171.27 7.71 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.284 2.234 . . . . 0.0 111.562 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -52.13 -57.62 14.51 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 124.625 1.17 . . . . 0.0 112.338 176.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.9 -33.19 27.16 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.516 1.477 . . . . 0.0 113.319 178.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.23 -47.14 80.83 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.166 -0.959 . . . . 0.0 112.603 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.4 mt -68.44 -53.28 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.089 0.556 . . . . 0.0 109.651 175.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -56.93 -35.84 69.52 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 119.023 -0.513 . . . . 0.0 112.068 -175.115 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 34.7 tttt -56.97 -58.32 8.66 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.194 1.798 . . . . 0.0 113.434 172.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -59.06 -40.06 84.0 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 122.962 0.505 . . . . 0.0 111.084 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.803 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.1 mm? -60.26 -50.33 74.08 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.369 1.068 . . . . 0.0 111.253 173.271 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.56 -33.25 71.19 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.62 -51.86 68.14 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.603 -0.686 . . . . 0.0 112.213 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.803 ' HE1' HD13 ' A' ' 40' ' ' LEU . 13.4 p-90 -73.8 -30.77 62.92 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 172.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.452 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -60.11 -32.15 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 O-C-N 120.781 -1.2 . . . . 0.0 112.677 174.427 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -58.0 -19.24 29.46 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 118.565 0.62 . . . . 0.0 112.268 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.89 -14.89 21.49 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.878 1.271 . . . . 0.0 113.222 177.273 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.643 HD11 ' CH2' ' A' ' 43' ' ' TRP . 22.8 mt . . . . . 0 N--CA 1.474 0.744 0 CA-C-N 118.99 0.814 . . . . 0.0 112.528 175.551 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -63.98 -51.9 62.15 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 124.183 0.993 . . . . 0.0 112.298 178.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -52.83 -39.12 62.2 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.329 173.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.08 -51.42 54.67 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.023 0.829 . . . . 0.0 111.885 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.4 mttm -58.87 -51.67 69.01 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.013 0.925 . . . . 0.0 111.272 175.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.22 -52.63 64.78 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.809 1.244 . . . . 0.0 111.963 177.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.83 -52.75 63.87 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.827 1.194 . . . . 0.0 112.863 178.429 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -62.85 -48.99 76.64 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.323 0.649 . . . . 0.0 112.314 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tp -54.84 -49.66 70.52 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.964 1.306 . . . . 0.0 111.171 174.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.22 -43.6 98.62 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.515 1.126 . . . . 0.0 111.729 178.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -58.25 -50.76 72.42 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.588 1.085 . . . . 0.0 111.954 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.96 -48.5 78.63 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.539 1.136 . . . . 0.0 112.633 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -57.3 -54.24 49.08 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.879 0.872 . . . . 0.0 110.979 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -40.99 72.87 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.998 1.319 . . . . 0.0 113.041 177.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.02 -52.63 64.71 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.479 0.712 . . . . 0.0 112.424 172.447 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.04 -31.49 72.05 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 176.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 62.8 t -73.04 -23.84 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 126.016 1.726 . . . . 0.0 112.63 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.78 -32.66 63.66 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.684 -1.26 . . . . 0.0 114.159 176.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -87.92 0.45 55.85 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.527 1.531 . . . . 0.0 114.551 174.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.3 mmt -94.57 -159.82 0.73 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.734 1.614 . . . . 0.0 111.254 -178.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.8 156.43 6.66 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.209 2.203 . . . . 0.0 114.038 173.512 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -69.38 -45.49 1.77 Allowed 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 123.692 2.928 . . . . 0.0 112.726 -176.305 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -59.67 -31.32 69.44 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.143 0.977 . . . . 0.0 112.223 176.248 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -66.03 -49.23 68.46 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.191 0.596 . . . . 0.0 110.283 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.02 -46.88 61.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.891 0.877 . . . . 0.0 110.714 172.482 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -58.93 -54.91 41.85 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.734 0.814 . . . . 0.0 111.162 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.69 -47.84 84.47 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.541 0.736 . . . . 0.0 112.75 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.85 -40.05 83.73 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.08 -45.74 92.19 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 119.455 1.025 . . . . 0.0 110.742 174.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.62 -44.05 89.86 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.117 0.967 . . . . 0.0 112.219 173.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.8 tp -63.96 -36.66 84.71 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 121.576 -0.703 . . . . 0.0 112.539 171.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.7 t -72.28 -39.35 68.39 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 120.357 -1.464 . . . . 0.0 112.899 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -71.16 -43.51 67.36 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.732 0.813 . . . . 0.0 110.989 175.599 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 7.3 tt -70.17 -32.13 49.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 118.588 0.631 . . . . 0.0 112.446 178.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.18 -30.21 64.32 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 CA--C 1.549 0.927 0 C-N-CA 125.256 1.422 . . . . 0.0 114.526 177.572 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.07 -38.98 8.63 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.688 1.595 . . . . 0.0 113.101 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.78 -59.5 5.33 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.314 173.593 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -63.74 -33.69 76.22 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.735 0.698 . . . . 0.0 111.7 -176.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -60.14 -47.91 83.93 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.288 1.035 . . . . 0.0 111.817 173.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -46.35 91.08 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 118.403 -0.808 . . . . 0.0 111.665 174.29 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 24.9 mm -53.19 -49.81 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 125.123 1.369 . . . . 0.0 111.194 174.183 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -63.31 -44.17 95.71 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.98 1.264 . . . . 0.0 112.603 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.24 -49.03 79.23 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 122.707 0.403 . . . . 0.0 111.151 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.4 pp -70.99 -31.98 46.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 118.289 -0.863 . . . . 0.0 112.497 174.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 79.3 t80 . . . . . 0 N--CA 1.471 0.614 0 CA-C-N 120.345 1.43 . . . . 0.0 111.904 178.154 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo . . . . . 0 CA--C 1.535 0.546 0 CA-C-O 121.143 0.393 . . . . 0.0 111.684 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -62.79 -22.5 66.66 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 176.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.9 m -62.61 -51.64 66.52 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.911 1.232 . . . . 0.0 112.256 174.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 9.4 p -73.6 -38.81 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 O-C-N 121.755 -0.591 . . . . 0.0 111.163 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 29.6 mmtt -58.31 -49.29 77.69 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.53 -0.731 . . . . 0.0 111.922 174.188 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -66.68 -43.56 84.14 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.445 1.02 . . . . 0.0 113.024 177.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -64.98 -36.74 85.39 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.368 -0.832 . . . . 0.0 112.429 179.046 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.67 -22.03 26.34 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.288 1.035 . . . . 0.0 113.128 179.313 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 . . . . . 0 N--CA 1.476 0.858 0 C-N-CA 125.703 1.601 . . . . 0.0 112.132 179.27 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 CA--C 1.547 1.125 0 CA-C-O 119.136 -0.443 . . . . 0.0 111.88 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -71.23 -23.58 24.22 Favored 'Trans proline' 0 CA--C 1.554 1.476 0 C-N-CA 122.32 2.013 . . . . 0.0 116.888 167.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -71.97 168.91 22.62 Favored 'Trans proline' 0 C--N 1.361 1.232 0 CA-C-N 124.26 2.557 . . . . 0.0 113.156 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -61.93 130.08 29.72 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.831 2.354 . . . . 0.0 110.988 173.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -55.04 -42.53 72.77 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.922 0.868 . . . . 0.0 111.632 174.361 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.545 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.2 pt? -78.73 17.02 0.75 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 127.991 2.516 . . . . 0.0 115.363 177.312 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -33.25 103.61 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 127.24 2.216 . . . . 0.0 115.325 -173.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.45 32.87 0.11 Allowed Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.095 1.331 . . . . 0.0 114.548 -172.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -125.23 157.79 66.12 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 125.621 1.568 . . . . 0.0 112.021 -175.811 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -74.44 169.08 23.32 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.065 2.51 . . . . 0.0 113.053 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -53.55 -37.29 62.74 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.65 1.18 . . . . 0.0 113.465 -177.149 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -57.27 -37.68 72.74 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.278 1.431 . . . . 0.0 112.671 176.043 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.0 t -82.65 -38.2 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.401 1.481 . . . . 0.0 112.194 174.078 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.1 t -57.56 -39.33 68.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.936 0.894 . . . . 0.0 110.742 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.5 tptm -61.13 -50.58 72.61 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.653 -1.28 . . . . 0.0 111.799 173.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -53.83 -47.27 71.09 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.237 0.615 . . . . 0.0 112.268 176.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -51.9 -52.97 46.11 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.388 1.075 . . . . 0.0 112.081 169.272 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -47.47 85.77 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.953 0.901 . . . . 0.0 113.331 -177.428 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.81 -38.89 92.79 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.422 0.689 . . . . 0.0 111.529 177.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 14.0 tp -63.71 -44.49 93.49 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 122.938 0.495 . . . . 0.0 111.969 172.244 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.58 -34.88 78.79 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.887 1.275 . . . . 0.0 113.871 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.9 mmtt -54.66 -32.95 59.97 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.844 1.202 . . . . 0.0 113.991 174.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.9 ttpp -69.1 -38.56 79.0 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.88 1.272 . . . . 0.0 112.715 172.467 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -104.17 14.35 30.6 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.709 1.604 . . . . 0.0 113.245 -172.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -22.3 41.58 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 120.33 -1.481 . . . . 0.0 114.694 -175.161 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.7 p -103.67 1.16 31.56 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 127.123 2.169 . . . . 0.0 114.847 179.472 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -76.81 170.65 16.08 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.39 1.476 . . . . 0.0 111.96 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.29 171.76 12.42 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.888 1.675 . . . . 0.0 111.915 175.27 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -50.97 -59.72 6.99 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 124.75 1.22 . . . . 0.0 112.218 174.597 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.547 ' HA ' ' HG3' ' A' ' 37' ' ' GLU . 59.2 Cg_endo -67.03 -28.86 41.11 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.296 1.997 . . . . 0.0 113.479 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -67.53 -50.05 60.51 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.064 -1.648 . . . . 0.0 112.586 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.7 mt -62.97 -53.4 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 CA-C-N 118.662 0.665 . . . . 0.0 110.022 176.596 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.547 ' HG3' ' HA ' ' A' ' 34' ' ' PRO . 2.0 pp20? -55.33 -42.33 73.65 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 117.866 -1.064 . . . . 0.0 111.244 -177.585 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -57.56 -51.39 69.69 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-N 119.672 1.124 . . . . 0.0 112.066 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -40.74 96.63 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.725 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.2 mm? -61.13 -51.12 70.41 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.687 0.795 . . . . 0.0 111.789 172.116 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.85 -30.45 71.51 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.149 -0.97 . . . . 0.0 113.106 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.16 -49.05 78.8 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.129 -0.982 . . . . 0.0 112.346 178.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.725 ' HE1' HD13 ' A' ' 40' ' ' LEU . 10.8 p-90 -73.72 -35.52 65.11 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 173.062 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.618 HG23 HD12 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -59.65 -30.68 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 124.898 1.279 . . . . 0.0 112.401 176.813 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -57.27 -14.51 4.48 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.909 0.884 . . . . 0.0 112.912 174.192 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.79 -12.11 16.0 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.645 1.578 . . . . 0.0 113.833 176.837 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.678 HD11 ' CH2' ' A' ' 43' ' ' TRP . 17.5 mt . . . . . 0 N--CA 1.474 0.766 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 176.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -61.08 -53.5 56.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.829 1.252 . . . . 0.0 111.989 178.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.9 mtmt -60.14 -31.89 70.51 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 119.032 -0.509 . . . . 0.0 112.344 175.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.43 -51.47 23.74 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.837 0.744 . . . . 0.0 111.455 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -58.76 -49.29 78.19 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.744 0.817 . . . . 0.0 110.791 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -60.96 -52.27 65.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.773 1.229 . . . . 0.0 112.131 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.8 -44.7 96.35 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 119.797 1.18 . . . . 0.0 113.258 179.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -67.53 -45.08 76.77 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.456 0.703 . . . . 0.0 111.954 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.01 -51.23 70.1 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.119 0.967 . . . . 0.0 110.949 170.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.4 -42.93 99.52 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.057 -179.049 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -56.31 -50.76 70.53 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.558 1.072 . . . . 0.0 111.965 173.212 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.55 82.05 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -60.65 -49.44 77.51 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.049 0.94 . . . . 0.0 111.046 176.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.63 -42.64 83.79 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.086 1.354 . . . . 0.0 112.993 175.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -56.25 -52.59 63.91 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.324 1.05 . . . . 0.0 112.171 172.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.88 -31.52 72.17 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 177.25 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.1 t -73.06 -24.8 21.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 125.812 1.645 . . . . 0.0 113.086 176.371 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.65 -30.59 65.54 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 177.271 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.2 1.28 54.8 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.729 1.611 . . . . 0.0 114.406 172.639 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.3 ttm -103.53 -158.57 0.67 Allowed 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 126.429 1.891 . . . . 0.0 111.558 -172.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.76 156.11 36.65 Favored Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 125.179 1.391 . . . . 0.0 113.958 178.393 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.65 -43.86 1.21 Allowed 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 123.44 2.76 . . . . 0.0 113.084 -176.027 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -58.97 -34.3 71.65 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.329 1.052 . . . . 0.0 112.107 175.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.72 -43.59 88.61 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 122.998 0.519 . . . . 0.0 110.241 177.474 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -42.82 77.26 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.219 1.008 . . . . 0.0 112.056 173.681 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -59.83 -54.29 47.99 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.466 1.107 . . . . 0.0 111.563 175.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.43 -51.52 69.53 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.232 1.013 . . . . 0.0 113.085 178.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.6 -34.83 76.45 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 179.082 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.35 -51.67 68.95 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.46 1.027 . . . . 0.0 109.92 172.166 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -52.93 -51.96 59.5 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.808 0.843 . . . . 0.0 111.947 173.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.27 -37.86 84.65 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.7 t -72.98 -37.72 66.92 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.282 1.033 . . . . 0.0 112.541 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -38.86 56.73 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 121.706 -0.621 . . . . 0.0 111.694 177.35 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 12.0 tt -70.71 -31.62 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 119.148 0.886 . . . . 0.0 112.778 175.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.11 -33.38 67.28 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 . . . . . 0 CA--C 1.544 0.749 0 C-N-CA 124.147 0.979 . . . . 0.0 113.559 171.583 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -48.52 -38.93 21.58 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.411 1.085 . . . . 0.0 113.36 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -59.3 -59.35 5.6 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.845 0.858 . . . . 0.0 111.626 174.156 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.89 -33.38 75.69 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -177.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.59 -51.02 71.68 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.645 1.178 . . . . 0.0 110.53 171.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -52.75 -51.88 58.78 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 117.715 -1.136 . . . . 0.0 111.095 172.326 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 10.4 mm -53.68 -48.5 60.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.284 0.947 . . . . 0.0 111.582 177.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -65.08 -44.11 89.99 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.31 -0.869 . . . . 0.0 113.209 178.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.08 78.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.951 0.9 . . . . 0.0 112.126 177.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.49 -37.15 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 122.853 0.461 . . . . 0.0 111.891 175.501 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 70.1 t80 . . . . . 0 N--CA 1.47 0.574 0 CA-C-N 119.458 1.026 . . . . 0.0 112.194 176.689 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo . . . . . 0 CA--C 1.538 0.719 0 CA-C-O 121.802 0.667 . . . . 0.0 112.932 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -63.98 -24.89 67.89 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.547 -0.721 . . . . 0.0 112.865 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.9 t -61.22 -51.64 68.14 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.229 -0.919 . . . . 0.0 111.981 177.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.1 p -73.97 -38.12 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 121.737 -0.602 . . . . 0.0 112.051 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.47 -48.84 76.26 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.073 0.851 . . . . 0.0 111.706 171.69 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -67.93 -42.5 80.94 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.306 0.957 . . . . 0.0 112.96 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -65.99 -34.25 77.67 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.137 0.881 . . . . 0.0 112.592 177.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.08 -22.82 25.18 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 178.361 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 . . . . . 0 N--CA 1.477 0.882 0 C-N-CA 125.511 1.525 . . . . 0.0 113.011 179.882 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo . . . . . 0 CA--C 1.543 0.947 0 CA-C-O 119.413 -0.328 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -67.64 -24.77 41.14 Favored 'Trans proline' 0 CA--C 1.554 1.497 0 C-N-CA 122.669 2.246 . . . . 0.0 116.492 167.421 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.6 166.36 26.16 Favored 'Trans proline' 0 C--N 1.361 1.223 0 CA-C-N 124.093 2.497 . . . . 0.0 112.8 175.356 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 35.0 Cg_endo -59.15 131.3 40.54 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 123.099 2.533 . . . . 0.0 111.626 171.546 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -48.4 -47.22 37.87 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.415 0.686 . . . . 0.0 111.818 170.068 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.56 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.8 pt? -83.47 18.06 1.96 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 126.6 1.96 . . . . 0.0 115.219 -178.577 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -32.92 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 127.018 2.127 . . . . 0.0 115.611 -172.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.09 27.71 0.17 Allowed Glycine 0 CA--C 1.537 1.453 0 C-N-CA 124.814 1.197 . . . . 0.0 114.448 -172.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.79 157.45 59.84 Favored Pre-proline 0 CA--C 1.552 1.036 0 C-N-CA 125.722 1.609 . . . . 0.0 111.663 -175.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -73.36 168.37 24.94 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.114 2.543 . . . . 0.0 112.923 -178.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -54.76 -38.24 66.97 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.532 1.133 . . . . 0.0 113.464 -177.113 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.76 -40.9 66.61 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.517 1.527 . . . . 0.0 112.428 173.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.1 t -80.69 -39.52 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 124.812 1.245 . . . . 0.0 111.683 176.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 59.5 t -56.28 -40.91 68.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.077 0.951 . . . . 0.0 111.105 177.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.7 tptm -61.28 -50.69 72.01 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 121.132 -0.98 . . . . 0.0 111.968 173.57 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -53.36 -47.58 69.29 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.531 0.733 . . . . 0.0 112.042 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.428 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -52.06 -53.79 38.02 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.676 1.191 . . . . 0.0 112.156 169.742 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.33 -47.61 84.77 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.27 0.941 . . . . 0.0 113.533 -178.305 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -68.61 -28.76 67.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.477 0.711 . . . . 0.0 112.295 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.3 tp -68.75 -48.53 63.51 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 121.56 -0.713 . . . . 0.0 111.668 165.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.71 -34.65 73.18 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.652 1.581 . . . . 0.0 113.905 -178.752 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -30.72 47.42 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.924 1.238 . . . . 0.0 113.099 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.4 -34.33 70.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.882 1.673 . . . . 0.0 112.372 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -109.85 16.84 21.73 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.952 2.101 . . . . 0.0 113.15 -175.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -20.59 56.65 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 119.974 -1.704 . . . . 0.0 114.529 -174.309 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.1 m -102.24 0.77 34.95 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.849 2.06 . . . . 0.0 113.086 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -74.33 175.96 7.15 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.23 1.412 . . . . 0.0 111.875 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.65 174.7 6.86 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.4 1.88 . . . . 0.0 111.902 175.62 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.78 -60.69 3.84 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 126.539 1.935 . . . . 0.0 112.774 172.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.85 -33.77 25.88 Favored 'Trans proline' 0 C--N 1.357 1.014 0 C-N-CA 121.881 1.721 . . . . 0.0 113.284 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -65.06 -46.16 82.32 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.118 -0.989 . . . . 0.0 112.224 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 66.7 mt -67.73 -53.29 32.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 122.931 0.493 . . . . 0.0 110.371 175.704 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -56.38 -38.33 71.3 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 118.403 0.547 . . . . 0.0 111.835 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -58.19 -57.17 14.02 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 125.227 1.411 . . . . 0.0 113.016 173.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -65.8 -35.47 80.79 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.756 0.312 . . . . 0.0 111.672 -175.224 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.779 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.7 mm? -64.54 -49.46 71.16 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.977 1.311 . . . . 0.0 111.732 170.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.26 -41.0 71.61 Favored 'General case' 0 N--CA 1.465 0.319 0 O-C-N 121.177 -0.952 . . . . 0.0 113.303 174.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.64 -48.7 71.95 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -175.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.779 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.1 p-90 -72.92 -36.01 67.16 Favored 'General case' 0 CA--C 1.554 1.119 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 168.568 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -32.85 39.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 125.258 1.423 . . . . 0.0 112.364 175.537 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -60.1 -15.63 25.04 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.827 0.851 . . . . 0.0 112.762 177.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 21.5 m -100.88 -17.99 16.58 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.414 1.486 . . . . 0.0 112.614 176.291 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.69 HD11 ' CH2' ' A' ' 43' ' ' TRP . 17.8 mt . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 178.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -51.93 64.02 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 124.866 1.266 . . . . 0.0 112.502 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -55.68 -38.65 69.92 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.918 0.887 . . . . 0.0 111.038 172.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.64 -46.92 67.92 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 123.117 0.567 . . . . 0.0 111.884 -178.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -59.57 -53.26 60.16 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.249 1.02 . . . . 0.0 111.581 175.13 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.2 -38.27 89.94 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.182 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.71 -50.85 69.49 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.316 0.962 . . . . 0.0 112.409 175.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.98 -44.61 84.42 Favored 'General case' 0 C--O 1.245 0.816 0 C-N-CA 123.197 0.599 . . . . 0.0 112.037 -178.129 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 26.6 mt -59.13 -51.29 70.66 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 124.297 1.039 . . . . 0.0 111.788 173.101 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.13 -40.87 97.38 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.996 179.046 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.8 tttm -58.29 -51.11 71.17 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.098 1.317 . . . . 0.0 111.994 174.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.0 -48.77 78.83 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.27 0.628 . . . . 0.0 112.44 177.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -58.87 -50.04 75.51 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.306 1.042 . . . . 0.0 110.941 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.11 -41.72 84.19 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.332 1.453 . . . . 0.0 113.269 175.623 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -55.76 -52.58 63.45 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.55 1.14 . . . . 0.0 112.209 172.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.55 -31.84 72.19 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 54.1 t -73.26 -24.27 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 C-N-CA 125.512 1.525 . . . . 0.0 112.783 176.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.68 -34.62 65.2 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 176.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.9 pttt -84.4 0.18 50.43 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.297 1.439 . . . . 0.0 114.349 174.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.7 ttm -103.0 -159.64 0.74 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.947 2.099 . . . . 0.0 111.445 -173.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -58.72 154.78 34.19 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 125.339 1.456 . . . . 0.0 113.665 178.459 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -68.51 -45.73 2.34 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.573 2.849 . . . . 0.0 112.762 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -33.48 72.63 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.966 1.306 . . . . 0.0 112.893 176.436 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.97 -48.72 75.32 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 122.795 0.438 . . . . 0.0 110.218 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.2 -44.84 68.28 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.95 173.365 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -59.44 -55.44 34.58 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.522 1.055 . . . . 0.0 110.903 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.89 -51.49 69.38 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.242 0.617 . . . . 0.0 112.251 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.75 -39.25 93.83 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.5 -44.44 94.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.26 0.936 . . . . 0.0 111.104 174.134 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.55 -45.42 88.99 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.502 0.721 . . . . 0.0 112.782 172.07 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.422 ' HA ' HG22 ' A' ' 94' ' ' ILE . 7.8 mp -64.47 -34.77 78.97 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.888 0.767 . . . . 0.0 112.372 173.111 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 15.6 t -70.9 -45.12 64.88 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 120.686 -1.259 . . . . 0.0 112.903 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? -66.47 -49.24 67.28 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.225 0.61 . . . . 0.0 109.987 175.067 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.422 HG22 ' HA ' ' A' ' 91' ' ' LEU . 9.1 tt -65.32 -32.39 58.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 118.958 0.799 . . . . 0.0 112.509 -176.57 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.34 -19.4 63.31 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 N--CA 1.475 0.793 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 170.637 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.513 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -46.94 -32.49 3.88 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.217 1.407 . . . . 0.0 113.247 169.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -55.56 -60.09 3.91 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.119 0.967 . . . . 0.0 111.336 169.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.513 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -65.99 -34.05 77.22 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.212 -0.93 . . . . 0.0 112.332 -176.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.71 -54.58 42.56 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.866 0.866 . . . . 0.0 110.83 171.374 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -56.06 -52.49 64.08 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 118.375 -0.821 . . . . 0.0 112.062 174.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.9 mm -51.84 -49.19 37.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.208 1.403 . . . . 0.0 111.073 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -67.15 -43.77 81.48 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.683 1.129 . . . . 0.0 112.842 178.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.14 -49.19 78.82 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.83 0.852 . . . . 0.0 111.319 177.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.4 pp -68.76 -37.3 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 118.615 -0.707 . . . . 0.0 112.247 174.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.6 t80 . . . . . 0 N--CA 1.473 0.705 0 C-N-CA 124.744 1.218 . . . . 0.0 112.68 177.568 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo . . . . . 0 CA--C 1.535 0.554 0 CA-C-O 121.747 0.645 . . . . 0.0 112.548 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.06 -23.95 66.8 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.912 176.512 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 61.3 m -68.72 -39.22 80.51 Favored 'General case' 0 C--N 1.352 0.677 0 CA-C-O 117.346 -1.312 . . . . 0.0 114.217 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.3 p -79.6 -37.82 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-N 119.098 0.863 . . . . 0.0 110.189 175.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -57.55 -48.26 79.8 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.126 0.875 . . . . 0.0 111.669 173.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -68.34 -43.01 78.45 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.086 0.857 . . . . 0.0 112.541 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -64.95 -32.87 74.8 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.251 -0.905 . . . . 0.0 112.859 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.406 HD12 ' C ' ' A' ' 124' ' ' LEU . 0.6 OUTLIER -90.86 -19.94 22.83 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.355 1.062 . . . . 0.0 113.418 179.618 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.477 0.913 0 C-N-CA 125.084 1.354 . . . . 0.0 112.815 178.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 . . . . . 0 CA--C 1.551 1.01 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -112.19 93.01 4.24 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.153 1.381 . . . . 0.0 110.756 177.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.8 p -138.83 160.38 63.26 Favored Pre-proline 0 N--CA 1.469 0.515 0 C-N-CA 125.348 1.459 . . . . 0.0 111.976 -176.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -66.91 169.26 15.19 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 123.576 2.851 . . . . 0.0 112.914 175.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.8 116.56 4.03 Favored 'Trans proline' 0 CA--C 1.548 1.176 0 C-N-CA 123.091 2.527 . . . . 0.0 112.043 172.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -73.7 -19.08 21.65 Favored 'Trans proline' 0 CA--C 1.554 1.493 0 C-N-CA 122.438 2.092 . . . . 0.0 116.604 165.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.78 168.39 23.91 Favored 'Trans proline' 0 C--N 1.362 1.24 0 CA-C-N 124.462 2.629 . . . . 0.0 112.353 176.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -60.44 127.96 24.51 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.673 2.249 . . . . 0.0 111.181 170.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -51.88 -41.71 62.12 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.522 0.677 . . . . 0.0 111.747 168.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.704 HD13 ' H ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -95.86 41.87 1.1 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 128.62 2.768 . . . . 0.0 112.954 176.772 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.6 112.68 0.58 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.873 1.269 . . . . 0.0 113.039 174.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.15 -16.45 2.12 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 126.128 1.823 . . . . 0.0 114.236 -177.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.05 160.42 78.37 Favored Pre-proline 0 CA--C 1.558 1.274 0 C-N-CA 125.535 1.534 . . . . 0.0 113.866 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -75.71 171.34 18.38 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.899 3.066 . . . . 0.0 113.545 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -53.86 -36.62 62.82 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.463 1.105 . . . . 0.0 113.785 -176.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -53.4 -42.34 66.87 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.711 1.604 . . . . 0.0 112.551 173.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 77.8 t -77.47 -41.55 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 124.649 1.18 . . . . 0.0 111.673 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.3 t -55.24 -37.81 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 118.641 0.655 . . . . 0.0 111.583 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.0 tptm -62.48 -50.67 70.49 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.245 -0.909 . . . . 0.0 111.865 172.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.49 -46.51 80.43 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.003 0.82 . . . . 0.0 112.515 176.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -53.84 49.17 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.775 0.83 . . . . 0.0 111.527 172.147 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -64.03 -44.93 91.05 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.521 1.055 . . . . 0.0 113.209 -178.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.42 -37.97 82.57 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.248 1.019 . . . . 0.0 111.589 177.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.445 HD23 HD22 ' A' ' 40' ' ' LEU . 12.6 tp -66.7 -46.02 76.92 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 122.966 0.506 . . . . 0.0 111.259 169.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.628 HD12 HD21 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -64.63 -42.53 95.41 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -178.666 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.36 -29.34 61.29 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.993 1.27 . . . . 0.0 113.361 177.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.7 tttp -72.67 -33.95 66.89 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.686 1.195 . . . . 0.0 112.989 175.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . 0.285 15.9 p30 -109.78 22.1 16.09 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.983 1.313 . . . . 0.0 113.934 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -58.72 -24.54 61.66 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.05 -1.656 . . . . 0.0 113.178 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 31.9 p -96.87 -0.89 47.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 127.522 2.329 . . . . 0.0 114.388 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -77.87 179.72 6.54 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.876 1.671 . . . . 0.0 112.969 173.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.86 171.5 9.56 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.378 2.271 . . . . 0.0 112.503 173.683 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -59.13 8.76 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 125.413 1.485 . . . . 0.0 112.556 175.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -66.43 -28.41 46.27 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 122.254 1.97 . . . . 0.0 113.65 -178.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -72.71 -39.89 66.6 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.439 -0.788 . . . . 0.0 111.669 -176.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 52.7 mt -70.52 -53.04 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.669 1.188 . . . . 0.0 110.21 171.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -57.97 -36.83 73.14 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 118.39 -0.814 . . . . 0.0 112.051 -176.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -52.79 -57.28 10.7 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.078 1.351 . . . . 0.0 111.77 172.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.38 -41.37 96.99 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.5 0.72 . . . . 0.0 111.691 -177.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.748 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.8 mm? -61.45 -47.45 85.67 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.001 0.92 . . . . 0.0 111.384 174.217 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -62.46 -38.6 90.43 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.323 1.049 . . . . 0.0 113.105 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.33 -49.93 68.58 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.405 -0.809 . . . . 0.0 112.578 179.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.748 ' HE1' HD13 ' A' ' 40' ' ' LEU . 7.6 p-90 -73.73 -33.93 64.54 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 172.535 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.549 HG23 HD12 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -58.44 -30.39 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 125.074 1.35 . . . . 0.0 112.82 174.538 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.83 -16.66 18.23 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 118.836 0.743 . . . . 0.0 112.875 176.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.44 -16.21 21.32 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.189 1.396 . . . . 0.0 113.902 173.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.628 HD11 ' CH2' ' A' ' 43' ' ' TRP . 40.2 mt -66.88 -65.11 0.72 Allowed 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.024 0.829 . . . . 0.0 112.629 175.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 77.59 90.8 0.3 Allowed Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.133 0.873 . . . . 0.0 112.592 -177.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -169.48 -167.24 29.75 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.204 1.383 . . . . 0.0 112.399 -178.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -56.66 -19.5 16.68 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.254 1.421 . . . . 0.0 113.426 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -55.88 -21.02 17.92 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.768 2.027 . . . . 0.0 113.545 173.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -36.56 63.25 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.126 1.77 . . . . 0.0 113.539 171.238 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.66 -40.64 72.89 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.122 0.969 . . . . 0.0 111.32 177.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -59.45 -43.75 93.12 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 117.941 -1.028 . . . . 0.0 111.575 168.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -56.96 -52.69 64.21 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 120.635 1.562 . . . . 0.0 112.911 172.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -58.5 -42.72 88.29 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.706 0.685 . . . . 0.0 111.673 -177.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.09 -37.17 69.63 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 178.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -64.41 -50.55 67.17 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 125.185 1.394 . . . . 0.0 112.173 177.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -53.76 -45.37 70.58 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 122.801 0.44 . . . . 0.0 110.876 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 49.4 mttm -59.94 -54.06 50.54 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.322 1.049 . . . . 0.0 113.125 172.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -55.32 -47.93 74.91 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.708 1.14 . . . . 0.0 112.604 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -61.5 -53.32 57.92 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 124.375 1.07 . . . . 0.0 112.156 177.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt -56.08 -35.6 67.16 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.574 0.749 . . . . 0.0 111.661 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.72 -50.57 34.85 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.838 0.855 . . . . 0.0 111.48 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.8 tttt -58.83 -49.71 76.7 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.554 0.742 . . . . 0.0 110.688 176.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -62.31 -49.16 76.74 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.636 0.774 . . . . 0.0 111.954 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.01 -44.55 94.5 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.006 0.821 . . . . 0.0 111.9 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -66.72 -46.27 76.03 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.601 0.761 . . . . 0.0 112.224 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.8 tt -54.93 -51.13 67.06 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.804 0.842 . . . . 0.0 111.166 169.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.52 -40.09 96.13 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 118.553 -0.736 . . . . 0.0 112.176 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -57.77 -50.92 71.63 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.724 1.21 . . . . 0.0 111.929 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.15 -48.56 73.13 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.314 0.646 . . . . 0.0 112.156 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -59.33 -48.91 79.83 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.161 0.984 . . . . 0.0 110.708 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -55.65 -46.36 77.48 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.763 1.225 . . . . 0.0 113.039 173.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -51.69 65.69 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.174 0.897 . . . . 0.0 111.772 176.24 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.43 -32.93 74.81 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 175.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 48.8 t -72.69 -25.42 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 125.312 1.445 . . . . 0.0 113.139 178.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.85 -29.63 67.1 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.1 ptmt -89.24 -3.19 58.64 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.863 1.665 . . . . 0.0 114.16 172.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.7 tpp -94.74 -163.54 1.06 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.339 1.856 . . . . 0.0 112.018 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -52.64 152.18 7.02 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 126.94 2.096 . . . . 0.0 114.118 172.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -72.52 -39.11 2.89 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.697 2.932 . . . . 0.0 113.876 -174.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -62.86 -33.04 74.44 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.102 -0.999 . . . . 0.0 112.437 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.26 -44.06 92.93 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.902 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.04 -42.63 65.92 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.098 1.359 . . . . 0.0 112.634 173.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.3 mmtm -65.5 -52.62 51.42 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.279 1.432 . . . . 0.0 111.681 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.87 -53.16 60.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.501 0.72 . . . . 0.0 112.16 173.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.31 -36.0 82.69 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.11 -48.48 81.53 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.133 0.879 . . . . 0.0 111.216 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -56.64 -49.58 74.6 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 171.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.2 mt -60.7 -35.17 75.62 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.543 0.737 . . . . 0.0 112.296 178.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.4 t -73.05 -46.55 51.11 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.678 1.191 . . . . 0.0 113.043 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -65.97 -43.03 89.05 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.514 -0.741 . . . . 0.0 110.89 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.1 tt -68.95 -34.62 65.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.88 -18.06 63.81 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -99.74 -19.16 16.88 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.282 1.033 . . . . 0.0 113.732 169.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -147.44 80.99 1.52 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.61 1.564 . . . . 0.0 112.014 -175.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -65.51 -25.1 67.31 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 120.655 -1.278 . . . . 0.0 113.246 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.8 t -67.21 -20.16 65.65 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.975 1.31 . . . . 0.0 113.861 177.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 78.5 mt -81.19 84.13 6.64 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.574 1.15 . . . . 0.0 110.379 173.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 14.1 m-20 -89.42 176.71 6.81 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.4 1.48 . . . . 0.0 112.146 170.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 93.89 -26.17 18.0 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.832 1.682 . . . . 0.0 114.029 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.491 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -63.85 -23.18 32.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-N 118.374 1.087 . . . . 0.0 112.54 176.488 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -48.72 -38.06 20.49 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.218 -0.926 . . . . 0.0 112.554 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -58.93 -59.33 5.63 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.289 0.636 . . . . 0.0 111.225 173.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.491 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.64 -35.37 80.79 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.934 0.788 . . . . 0.0 112.623 -176.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 9.0 tm0? -59.09 -46.25 88.77 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.926 0.89 . . . . 0.0 111.554 171.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -50.35 74.03 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.396 -0.812 . . . . 0.0 111.494 173.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 31.0 mm -51.11 -50.84 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 124.793 1.237 . . . . 0.0 110.797 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -64.03 -45.99 86.45 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.604 0.638 . . . . 0.0 112.053 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.15 -44.78 83.75 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.501 0.72 . . . . 0.0 111.8 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 28.0 pt -71.54 -41.11 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-O 118.746 -0.645 . . . . 0.0 112.556 173.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -57.15 -39.79 75.92 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.362 1.437 . . . . 0.0 112.857 -178.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -66.59 -16.03 63.87 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.125 1.37 . . . . 0.0 113.038 176.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.0 t -122.31 21.09 10.43 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.701 2.0 . . . . 0.0 113.102 176.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 30.1 mt -109.36 75.89 0.78 Allowed Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 126.544 1.938 . . . . 0.0 110.531 170.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.14 168.65 18.57 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.934 2.423 . . . . 0.0 111.975 171.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -63.2 -23.39 67.41 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.317 -0.865 . . . . 0.0 112.791 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.3 m -62.44 -51.7 66.48 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.318 0.963 . . . . 0.0 112.118 176.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.476 HG22 HD23 ' A' ' 124' ' ' LEU . 10.8 p -72.23 -39.96 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 118.249 0.477 . . . . 0.0 111.414 178.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.82 -46.42 84.73 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.779 173.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -69.18 -40.27 78.19 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.605 1.093 . . . . 0.0 113.438 177.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -68.65 -31.28 70.31 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 121.039 -1.038 . . . . 0.0 113.055 177.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.476 HD23 HG22 ' A' ' 120' ' ' VAL . 0.6 OUTLIER -93.34 -16.95 24.11 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.447 1.099 . . . . 0.0 113.594 178.486 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -53.38 -38.52 63.44 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.939 1.296 . . . . 0.0 112.367 174.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.7 tttt -80.64 -31.06 36.58 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 173.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 168.98 -97.16 0.12 Allowed Glycine 0 CA--C 1.532 1.154 0 N-CA-C 114.925 0.73 . . . . 0.0 114.925 172.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.35 61.05 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 125.643 1.577 . . . . 0.0 111.185 -171.102 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 51.65 74.75 0.26 Allowed Glycine 0 CA--C 1.54 1.604 0 C-N-CA 126.058 1.789 . . . . 0.0 113.076 -174.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.87 108.42 2.1 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.932 3.088 . . . . 0.0 111.984 -174.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 48.3 63.98 1.85 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.779 2.032 . . . . 0.0 113.771 -176.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 42.3 t -116.98 133.09 23.14 Favored Pre-proline 0 N--CA 1.48 1.033 0 C-N-CA 125.939 1.696 . . . . 0.0 110.495 -176.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -70.47 177.06 6.46 Favored 'Trans proline' 0 CA--C 1.546 1.109 0 C-N-CA 123.872 3.048 . . . . 0.0 113.302 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.252 1.236 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 175.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 . . . . . 0 CA--C 1.545 0.77 0 CA-C-O 121.003 0.43 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -153.03 -65.69 0.16 Allowed 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.232 -0.918 . . . . 0.0 112.327 174.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.7 p -115.58 162.79 23.22 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 126.86 2.064 . . . . 0.0 112.482 -179.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.63 167.71 22.0 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.089 2.526 . . . . 0.0 113.506 176.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -64.4 127.13 18.34 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.79 2.993 . . . . 0.0 111.648 175.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.81 -25.29 39.54 Favored 'Trans proline' 0 CA--C 1.551 1.368 0 C-N-CA 122.442 2.095 . . . . 0.0 116.367 167.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.4 163.87 34.85 Favored 'Trans proline' 0 C--N 1.362 1.254 0 CA-C-N 124.116 2.506 . . . . 0.0 112.754 176.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 36.8 Cg_endo -61.4 133.81 48.17 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.9 2.4 . . . . 0.0 111.34 171.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -49.9 -43.67 49.67 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.335 0.654 . . . . 0.0 111.669 169.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.551 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.8 pt? -83.06 18.91 1.53 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.216 1.807 . . . . 0.0 115.102 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.36 105.59 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.625 1.97 . . . . 0.0 115.24 -173.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.28 26.68 0.2 Allowed Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.757 1.17 . . . . 0.0 114.661 -172.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -120.97 156.85 56.33 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 126.198 1.799 . . . . 0.0 112.01 -174.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.404 ' O ' HG23 ' A' ' 18' ' ' VAL . 81.8 Cg_endo -73.45 166.39 29.98 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 123.394 2.73 . . . . 0.0 113.239 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -52.46 -41.02 62.96 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.512 1.525 . . . . 0.0 113.133 -179.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -55.36 -39.54 70.18 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.883 1.673 . . . . 0.0 113.027 175.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 74.8 t -80.35 -40.33 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 124.881 1.273 . . . . 0.0 111.705 175.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 14' ' ' PRO . 54.1 t -55.9 -39.81 58.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.876 0.87 . . . . 0.0 110.987 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -59.72 -50.66 72.96 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 121.002 -1.061 . . . . 0.0 112.178 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.57 -47.02 83.23 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.852 0.861 . . . . 0.0 111.818 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.406 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.9 OUTLIER -51.96 -50.09 61.93 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.498 1.119 . . . . 0.0 111.861 168.182 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -44.82 95.52 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.225 0.92 . . . . 0.0 113.038 -178.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -65.85 -34.86 79.13 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.546 -0.721 . . . . 0.0 111.789 176.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 tp -66.64 -41.05 88.87 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 171.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -72.23 -25.56 61.68 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.5 mmtt -53.62 -46.76 70.55 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.583 1.083 . . . . 0.0 113.051 175.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.0 ptmt -70.06 -24.77 63.3 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 173.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -104.21 17.56 23.88 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 126.761 2.025 . . . . 0.0 113.008 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.68 -19.07 65.52 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.185 -1.572 . . . . 0.0 113.175 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.2 p -98.6 3.41 47.96 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.871 2.469 . . . . 0.0 114.206 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -73.37 179.61 3.89 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.426 1.49 . . . . 0.0 112.802 173.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -117.65 172.49 7.32 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 127.513 2.325 . . . . 0.0 111.227 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.7 -57.62 6.53 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 126.544 1.938 . . . . 0.0 112.826 176.35 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -69.73 -37.33 9.38 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.349 2.033 . . . . 0.0 113.426 177.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -64.79 -41.57 95.72 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 120.788 -1.195 . . . . 0.0 112.269 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 56.8 mt -67.14 -53.29 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-O 118.431 -0.795 . . . . 0.0 109.428 174.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -57.39 -41.04 79.5 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.555 1.071 . . . . 0.0 112.187 -175.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 6.5 mmpt? -57.14 -60.79 3.08 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.3 1.44 . . . . 0.0 112.806 174.382 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.14 -33.96 77.27 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -174.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.711 HD13 ' HE1' ' A' ' 43' ' ' TRP . 0.9 OUTLIER -66.93 -50.14 63.31 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 124.649 1.179 . . . . 0.0 111.235 173.488 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -55.28 -39.42 69.84 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.983 0.81 . . . . 0.0 112.912 175.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.36 -50.23 67.97 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.711 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.4 p-90 -73.8 -34.5 64.64 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 169.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -56.56 -32.19 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 125.194 1.397 . . . . 0.0 112.193 174.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.28 -19.27 44.74 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 118.935 0.789 . . . . 0.0 112.686 177.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 48.9 m -89.95 -24.49 21.28 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.983 1.313 . . . . 0.0 112.898 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.707 HD11 ' CH2' ' A' ' 43' ' ' TRP . 37.5 mt -64.12 -60.44 3.22 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 66.38 66.66 2.3 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.436 1.017 . . . . 0.0 114.044 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -147.71 53.04 0.54 Allowed Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.323 1.439 . . . . 0.0 113.758 -177.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.2 -3.12 2.15 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 128.705 2.802 . . . . 0.0 114.48 -176.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -62.32 -22.83 66.37 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.04 1.736 . . . . 0.0 114.252 -178.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.0 ptmt -53.58 -35.57 60.96 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.111 1.764 . . . . 0.0 113.427 172.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.78 -42.45 77.38 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.112 0.965 . . . . 0.0 112.147 176.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -56.85 -46.33 81.82 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.154 -0.966 . . . . 0.0 111.244 169.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -57.76 -46.12 84.97 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 174.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -58.31 -43.09 88.0 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.12 0.873 . . . . 0.0 110.975 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.99 -36.04 64.49 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -67.07 -52.64 39.63 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.077 -1.014 . . . . 0.0 112.604 174.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.2 ttpp -50.3 -52.33 37.49 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.733 0.813 . . . . 0.0 111.742 178.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 34.7 pttt -62.14 -42.06 98.88 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 118.185 -0.912 . . . . 0.0 113.418 175.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -57.38 -48.94 77.74 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.932 1.242 . . . . 0.0 111.73 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 13.3 mmt -64.27 -50.02 69.57 Favored 'General case' 0 N--CA 1.462 0.169 0 C-N-CA 123.032 0.533 . . . . 0.0 112.174 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -57.38 -35.02 69.46 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.292 0.637 . . . . 0.0 112.197 175.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.83 -51.5 22.14 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.236 1.014 . . . . 0.0 111.805 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -50.98 70.79 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.758 0.823 . . . . 0.0 110.599 174.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -60.88 -50.43 73.47 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.213 0.605 . . . . 0.0 111.99 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.13 92.95 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.803 0.728 . . . . 0.0 112.65 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -64.02 -50.33 68.9 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.772 0.829 . . . . 0.0 112.088 176.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 42.2 mt -55.66 -51.07 68.48 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.417 1.087 . . . . 0.0 110.724 175.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.428 ' HB1' ' HA ' ' A' ' 92' ' ' SER . . . -54.37 -51.35 65.09 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.118 0.967 . . . . 0.0 113.108 172.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -53.16 -50.74 63.97 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 120.218 1.372 . . . . 0.0 112.268 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.29 -48.85 74.1 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.424 0.689 . . . . 0.0 112.35 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.487 ' O ' HG23 ' A' ' 77' ' ' VAL . 8.9 m-70 -55.57 -52.88 62.27 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 123.804 0.842 . . . . 0.0 110.88 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -52.08 -46.96 65.4 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.997 2.119 . . . . 0.0 112.295 177.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -48.55 78.1 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.848 0.859 . . . . 0.0 112.26 174.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.63 -33.88 76.63 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 173.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 73' ' ' HIS . 92.6 t -69.98 -28.14 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 125.293 1.437 . . . . 0.0 111.925 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.04 -20.2 37.28 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 176.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.91 1.31 26.6 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 126.299 1.84 . . . . 0.0 114.173 173.28 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 tpp -98.64 -161.59 0.89 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.701 2.001 . . . . 0.0 112.025 -175.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.1 156.5 20.1 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 125.507 1.523 . . . . 0.0 113.942 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.56 -42.55 2.5 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.728 2.952 . . . . 0.0 113.345 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.64 -36.55 83.18 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.899 1.28 . . . . 0.0 112.571 177.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.62 -40.99 89.38 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.756 175.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -56.12 -45.72 79.42 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 117.852 -1.07 . . . . 0.0 112.368 176.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.31 -53.73 50.87 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.375 1.47 . . . . 0.0 111.369 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.63 -55.05 36.66 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.653 0.781 . . . . 0.0 111.885 176.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.25 -32.35 71.5 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -176.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.92 -46.38 89.61 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.023 -1.048 . . . . 0.0 111.856 170.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -58.53 -50.42 73.82 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.445 0.698 . . . . 0.0 111.977 171.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.2 mp -57.83 -34.58 69.83 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.646 0.657 . . . . 0.0 111.833 174.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.428 ' HA ' ' HB1' ' A' ' 70' ' ' ALA . 14.5 t -69.82 -50.83 39.01 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.012 -1.055 . . . . 0.0 112.657 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? -64.71 -40.2 94.94 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 118.677 -0.678 . . . . 0.0 110.898 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.5 tp -70.37 -37.15 69.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 119.224 0.92 . . . . 0.0 111.824 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.93 -21.0 65.13 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -176.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.91 -5.34 14.36 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.903 1.281 . . . . 0.0 113.634 174.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -156.63 78.4 0.93 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.33 1.452 . . . . 0.0 113.374 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -66.4 -12.84 59.2 Favored 'General case' 0 CA--C 1.55 0.953 0 O-C-N 120.19 -1.569 . . . . 0.0 113.504 177.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 t -74.93 -6.07 47.22 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.003 1.721 . . . . 0.0 114.502 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.7 mt -113.63 84.18 1.98 Allowed 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.354 1.462 . . . . 0.0 110.72 -177.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -94.23 153.22 18.17 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.682 0.793 . . . . 0.0 111.555 172.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 141.78 -69.33 0.44 Allowed Glycine 0 CA--C 1.529 0.965 0 C-N-CA 124.688 1.137 . . . . 0.0 112.805 -177.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -59.66 -27.88 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 CA-C-N 118.214 1.007 . . . . 0.0 112.591 -178.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -41.3 -46.43 3.23 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.906 1.682 . . . . 0.0 113.025 170.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -59.67 -59.13 5.92 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.615 0.766 . . . . 0.0 111.617 176.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.23 -35.62 80.9 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.671 0.789 . . . . 0.0 112.833 -175.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -53.86 -50.9 65.25 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 124.784 1.233 . . . . 0.0 110.779 167.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.4 tttt -57.29 -49.2 76.84 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.424 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 9.9 mm -54.74 -48.67 72.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.898 0.879 . . . . 0.0 111.758 176.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -64.5 -45.12 88.65 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.296 0.953 . . . . 0.0 112.844 177.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.51 -48.92 79.79 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.433 1.093 . . . . 0.0 111.822 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -68.88 -38.41 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.061 0.544 . . . . 0.0 112.142 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -62.56 -30.97 71.7 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.61 1.095 . . . . 0.0 113.016 177.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 10.2 mmtt -77.68 -11.1 59.84 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.111 1.364 . . . . 0.0 113.948 176.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.7 t -130.82 22.82 4.98 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.482 1.513 . . . . 0.0 112.763 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.56 HD23 ' HG3' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -48.02 142.87 7.07 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 126.121 1.769 . . . . 0.0 112.9 -177.047 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -70.85 110.74 2.85 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.27 1.98 . . . . 0.0 110.45 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -55.05 -30.46 59.63 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.596 -0.69 . . . . 0.0 111.818 176.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 46.7 p -56.69 -50.73 71.26 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.066 1.746 . . . . 0.0 113.202 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.94 -41.79 94.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 CA-C-N 119.619 1.099 . . . . 0.0 110.507 177.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.56 ' HG3' HD23 ' A' ' 116' ' ' LEU . 27.5 mttt -62.55 -46.27 89.15 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.356 177.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.52 -37.86 87.97 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.978 1.263 . . . . 0.0 113.244 176.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.74 -37.43 73.46 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.271 -0.893 . . . . 0.0 112.531 177.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -87.02 -19.11 29.14 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.445 1.098 . . . . 0.0 113.272 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.08 -37.44 61.67 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.789 1.636 . . . . 0.0 112.131 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -68.81 -43.88 74.66 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.186 1.394 . . . . 0.0 112.134 175.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 46.19 -136.03 8.98 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 125.243 1.401 . . . . 0.0 112.037 -175.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.1 pp -148.74 54.1 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 126.075 1.75 . . . . 0.0 111.542 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 49.84 75.1 0.22 Allowed Glycine 0 CA--C 1.54 1.606 0 C-N-CA 125.876 1.703 . . . . 0.0 113.115 -174.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -69.93 156.58 62.54 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.131 2.554 . . . . 0.0 111.993 -175.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 59.8 108.14 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 127.021 2.128 . . . . 0.0 113.13 -171.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 7.5 t -116.23 72.83 4.98 Favored Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 124.354 1.062 . . . . 0.0 110.366 177.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -74.23 -11.2 22.94 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.707 2.938 . . . . 0.0 114.144 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.18 0 C-N-CA 129.533 3.133 . . . . 0.0 114.49 -177.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.9 t70 . . . . . 0 N--CA 1.476 0.85 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.2 89.47 0.65 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.335 1.454 . . . . 0.0 111.984 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 p -96.47 160.48 29.48 Favored Pre-proline 0 C--O 1.238 0.465 0 C-N-CA 125.218 1.407 . . . . 0.0 112.458 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.71 162.84 37.64 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.779 2.986 . . . . 0.0 111.664 176.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -64.65 126.69 17.24 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.826 2.35 . . . . 0.0 110.772 175.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -68.19 -22.54 40.49 Favored 'Trans proline' 0 CA--C 1.552 1.383 0 C-N-CA 122.341 2.027 . . . . 0.0 116.281 167.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -69.89 167.95 23.13 Favored 'Trans proline' 0 C--N 1.362 1.274 0 CA-C-N 124.531 2.654 . . . . 0.0 113.828 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -61.21 119.74 7.05 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 123.629 2.886 . . . . 0.0 111.772 173.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -54.0 -27.87 34.47 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 172.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.478 HD13 ' H ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -108.08 35.34 3.18 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 128.122 2.569 . . . . 0.0 112.693 178.426 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -41.93 112.46 0.33 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.475 1.51 . . . . 0.0 114.044 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 151.42 -17.66 0.89 Allowed Glycine 0 CA--C 1.539 1.553 0 C-N-CA 126.588 2.042 . . . . 0.0 113.929 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.14 159.25 65.65 Favored Pre-proline 0 CA--C 1.553 1.089 0 C-N-CA 125.598 1.559 . . . . 0.0 113.919 -175.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.66 172.19 16.71 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.643 2.895 . . . . 0.0 113.27 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -53.65 -34.07 57.37 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.549 1.139 . . . . 0.0 113.438 -179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.62 -36.08 71.31 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.503 1.521 . . . . 0.0 112.65 175.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.46 HG13 ' HH2' ' A' ' 43' ' ' TRP . 43.3 t -79.14 -43.02 24.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 125.113 1.365 . . . . 0.0 111.553 170.132 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 86.0 t -53.36 -37.9 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 119.035 0.834 . . . . 0.0 111.642 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tppt? -61.14 -51.1 70.49 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.001 -1.062 . . . . 0.0 112.402 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.12 -49.48 76.83 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.668 0.787 . . . . 0.0 111.283 176.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.06 -52.34 44.29 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.33 1.052 . . . . 0.0 111.827 171.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -61.41 -45.47 94.2 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.89 1.223 . . . . 0.0 113.226 -178.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -69.83 -26.42 64.22 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 122.949 0.5 . . . . 0.0 112.282 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -72.84 -54.15 9.56 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.005 0.922 . . . . 0.0 111.903 168.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.22 -43.12 82.54 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.704 1.602 . . . . 0.0 114.131 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.91 -27.11 64.94 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.508 1.049 . . . . 0.0 112.942 175.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -38.08 66.94 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.966 1.706 . . . . 0.0 112.501 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.98 19.47 19.53 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.08 2.152 . . . . 0.0 113.99 177.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -59.23 -23.54 62.4 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 119.595 -1.941 . . . . 0.0 113.418 -176.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.2 p -82.14 2.13 32.94 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 128.929 2.892 . . . . 0.0 115.072 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -93.08 -176.06 4.05 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 126.548 1.939 . . . . 0.0 112.417 173.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.45 167.15 11.17 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.31 2.244 . . . . 0.0 111.745 174.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -43.5 -59.8 3.06 Favored Pre-proline 0 N--CA 1.473 0.705 0 C-N-CA 125.704 1.602 . . . . 0.0 113.313 174.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -66.75 -35.82 26.54 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 121.827 1.684 . . . . 0.0 113.642 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.42 -50.77 71.48 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.686 1.194 . . . . 0.0 111.324 -177.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 10.4 mt -66.94 -48.43 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.3 1.04 . . . . 0.0 112.379 172.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -49.49 -46.07 47.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.643 0.777 . . . . 0.0 110.574 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -52.04 -47.78 64.88 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.508 1.049 . . . . 0.0 113.328 174.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -63.13 -49.16 75.47 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.286 1.034 . . . . 0.0 111.79 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.703 HD13 ' HE1' ' A' ' 43' ' ' TRP . 4.0 mm? -58.75 -48.93 79.52 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.975 0.91 . . . . 0.0 110.433 176.04 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.439 ' HA ' ' HB ' ' A' ' 44' ' ' VAL . 31.7 m-20 -58.54 -35.29 72.09 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 125.008 1.323 . . . . 0.0 114.297 176.424 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.15 -53.49 57.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.553 0.615 . . . . 0.0 112.437 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.703 ' HE1' HD13 ' A' ' 40' ' ' LEU . 12.0 p-90 -73.29 -29.75 62.93 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 113.18 0.808 . . . . 0.0 113.18 175.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.703 HG22 HD12 ' A' ' 47' ' ' LEU . 1.6 t -60.22 -33.51 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.301 1.84 . . . . 0.0 113.588 172.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -56.71 -15.24 4.19 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 119.115 0.87 . . . . 0.0 112.818 173.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.18 -6.7 16.28 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.587 1.555 . . . . 0.0 114.147 176.25 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.703 HD12 HG22 ' A' ' 44' ' ' VAL . 13.6 mt -63.29 -60.02 3.94 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.671 1.123 . . . . 0.0 113.415 177.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -167.1 -150.59 6.5 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 125.686 1.612 . . . . 0.0 110.589 -168.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -123.8 4.89 9.17 Favored Glycine 0 N--CA 1.47 0.961 0 N-CA-C 116.988 1.555 . . . . 0.0 116.988 -174.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -102.82 -37.5 7.83 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.808 1.643 . . . . 0.0 111.983 173.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -74.63 -24.26 58.82 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.045 0.938 . . . . 0.0 112.171 -177.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.97 -33.1 62.1 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.543 1.537 . . . . 0.0 113.732 170.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.19 -33.19 75.22 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.13 0.572 . . . . 0.0 111.336 176.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -63.61 -39.55 94.66 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.692 172.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -64.62 -54.15 36.41 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 119.657 1.117 . . . . 0.0 113.192 174.06 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.48 -40.73 87.91 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.933 -0.48 . . . . 0.0 111.809 -178.4 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.6 -38.25 67.86 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.99 0.916 . . . . 0.0 112.452 178.17 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.401 ' CE1' ' HB2' ' A' ' 62' ' ' MET . 4.3 t80 -55.8 -50.65 69.9 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 124.412 1.085 . . . . 0.0 111.475 173.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 ttmm -50.22 -49.83 51.55 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.535 0.607 . . . . 0.0 111.107 -177.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -59.7 -54.35 47.4 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.479 1.512 . . . . 0.0 113.744 172.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -52.63 -47.31 67.12 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.08 0.952 . . . . 0.0 112.066 178.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.401 ' HB2' ' CE1' ' A' ' 58' ' ' PHE . 0.9 OUTLIER -61.97 -52.8 62.55 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.878 1.271 . . . . 0.0 112.335 177.319 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -54.74 -34.65 62.78 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.819 -0.61 . . . . 0.0 112.505 174.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.71 -51.96 24.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.97 0.805 . . . . 0.0 111.933 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -58.84 -47.45 84.81 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.37 0.668 . . . . 0.0 111.482 177.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -60.73 -50.95 71.4 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.739 1.216 . . . . 0.0 112.08 176.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.79 -49.61 74.83 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.773 1.169 . . . . 0.0 112.915 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -62.37 -50.67 70.65 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.878 0.871 . . . . 0.0 112.201 178.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tp -56.04 -50.3 71.33 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.662 0.785 . . . . 0.0 111.156 175.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.88 -45.75 85.9 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.347 1.059 . . . . 0.0 111.915 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.5 tptt -57.48 -48.42 79.25 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.564 1.075 . . . . 0.0 112.425 176.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.84 78.44 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.455 0.702 . . . . 0.0 112.254 176.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.418 ' O ' HG23 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -58.39 -50.0 75.25 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.737 1.215 . . . . 0.0 110.878 178.544 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -51.96 -49.47 63.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 126.382 1.873 . . . . 0.0 112.401 172.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -56.18 -49.08 75.02 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.687 0.795 . . . . 0.0 111.97 178.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.9 -33.41 75.53 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 174.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 73' ' ' HIS . 56.0 t -69.51 -27.54 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.814 1.246 . . . . 0.0 112.679 178.469 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.16 -28.73 42.19 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 175.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -98.63 -1.76 40.07 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.973 1.709 . . . . 0.0 114.463 175.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -90.24 -84.68 0.23 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.421 1.088 . . . . 0.0 111.251 175.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -129.97 154.21 81.14 Favored Pre-proline 0 N--CA 1.479 1.02 0 C-N-CA 126.508 1.923 . . . . 0.0 112.991 -173.488 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -69.93 -48.31 0.71 Allowed 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 123.683 2.922 . . . . 0.0 112.611 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -72.66 -33.72 66.75 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.88 -41.55 82.77 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 119.024 -0.513 . . . . 0.0 110.323 174.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.66 -48.98 74.13 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 117.87 -1.062 . . . . 0.0 110.302 173.338 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -56.38 -54.03 50.36 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.22 0.918 . . . . 0.0 110.736 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.08 -50.82 72.62 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.364 -0.835 . . . . 0.0 113.247 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -67.46 -44.16 79.3 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.815 0.846 . . . . 0.0 112.589 -177.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.86 93.77 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.441 1.097 . . . . 0.0 111.912 173.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.401 ' OE1' ' HE3' ' A' ' 93' ' ' LYS . 0.5 OUTLIER -59.99 -44.02 94.79 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.163 0.585 . . . . 0.0 111.73 174.367 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.442 ' HA ' HG22 ' A' ' 94' ' ' ILE . 1.8 mm? -63.47 -35.05 79.17 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 172.376 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.3 t -69.6 -47.24 64.17 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.43 1.092 . . . . 0.0 112.485 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.401 ' HE3' ' OE1' ' A' ' 90' ' ' GLU . 1.6 ptpm? -67.95 -41.58 82.25 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.615 0.766 . . . . 0.0 111.157 177.072 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.442 HG22 ' HA ' ' A' ' 91' ' ' LEU . 7.2 tt -71.07 -32.91 49.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 118.986 0.812 . . . . 0.0 112.6 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.64 -30.36 68.67 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.08 -4.43 16.61 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.755 1.222 . . . . 0.0 113.69 177.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -157.83 79.88 0.86 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.297 1.439 . . . . 0.0 112.718 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -64.92 -12.48 49.77 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 120.236 -1.54 . . . . 0.0 114.12 176.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.8 t -82.14 -14.05 56.28 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.261 1.425 . . . . 0.0 113.833 176.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 77.4 mt -76.69 84.1 3.32 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.03 -1.044 . . . . 0.0 110.921 169.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -92.62 169.25 10.66 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.265 1.026 . . . . 0.0 111.854 168.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 120.94 -74.3 0.34 Allowed Glycine 0 N--CA 1.47 0.91 0 C-N-CA 126.046 1.784 . . . . 0.0 111.801 177.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.41 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.2 OUTLIER -59.39 -27.72 37.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 123.717 0.807 . . . . 0.0 112.578 -177.427 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -31.5 4.42 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.344 1.458 . . . . 0.0 114.078 173.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -62.15 -59.81 4.52 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.115 171.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.41 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -62.33 -35.13 78.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.394 0.997 . . . . 0.0 112.269 -177.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -59.11 -49.45 77.84 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.616 0.766 . . . . 0.0 112.416 172.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.59 -51.84 67.12 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 117.786 -1.102 . . . . 0.0 110.993 172.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 31.3 mm -49.72 -49.91 19.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.619 1.168 . . . . 0.0 111.355 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -62.09 -52.18 64.93 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.693 0.679 . . . . 0.0 111.856 176.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.1 -33.77 71.23 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.9 pt -79.33 -39.76 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 118.161 -0.923 . . . . 0.0 112.069 169.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 93.7 t80 -54.85 -38.95 68.1 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 121.308 1.867 . . . . 0.0 113.837 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.23 -16.98 64.61 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 174.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.7 t -132.67 35.66 3.58 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.246 2.218 . . . . 0.0 112.56 -177.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 9.3 mt -109.15 72.31 0.5 Allowed Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 126.919 2.088 . . . . 0.0 110.109 174.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.23 170.95 11.05 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 123.256 2.637 . . . . 0.0 112.734 173.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -59.16 -26.87 65.13 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 173.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 23.5 p -65.59 -50.08 66.41 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 120.027 1.285 . . . . 0.0 112.833 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.4 p -69.06 -39.3 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.42 0.688 . . . . 0.0 111.551 175.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 10.0 mtpt -59.13 -47.05 86.69 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 118.254 -0.879 . . . . 0.0 112.372 171.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -65.98 -41.28 91.35 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 119.971 1.26 . . . . 0.0 112.786 177.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.08 -37.06 80.8 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.986 -1.072 . . . . 0.0 112.835 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.44 -19.13 31.77 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.474 1.109 . . . . 0.0 113.309 178.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -55.56 -21.9 19.35 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.492 1.917 . . . . 0.0 113.922 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -57.3 -29.15 63.67 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.621 1.568 . . . . 0.0 113.326 170.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 122.08 -175.69 16.36 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 126.192 1.853 . . . . 0.0 113.672 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -132.77 63.76 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 126.315 1.846 . . . . 0.0 111.274 -171.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 51.4 75.3 0.22 Allowed Glycine 0 CA--C 1.542 1.772 0 C-N-CA 125.784 1.659 . . . . 0.0 113.348 -175.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -70.31 172.15 13.71 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.733 2.956 . . . . 0.0 112.958 -176.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -134.79 93.59 3.05 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.176 1.391 . . . . 0.0 111.637 -177.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 14.9 p -83.0 133.68 47.87 Favored Pre-proline 0 N--CA 1.477 0.895 0 C-N-CA 124.733 1.213 . . . . 0.0 111.264 175.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -70.92 -178.39 2.76 Favored 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 123.741 2.961 . . . . 0.0 112.641 173.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.252 1.215 0 C-N-CA 125.374 1.47 . . . . 0.0 112.413 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 2.2 t70 . . . . . 0 CA--C 1.548 0.871 0 CA-C-O 120.952 0.406 . . . . 0.0 111.804 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.95 145.7 53.4 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 121.259 -0.901 . . . . 0.0 111.924 174.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -79.0 159.13 73.96 Favored Pre-proline 0 N--CA 1.474 0.747 0 C-N-CA 124.586 1.154 . . . . 0.0 113.343 177.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -69.94 167.53 24.41 Favored 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 123.77 2.98 . . . . 0.0 112.064 176.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.73 129.07 22.49 Favored 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 123.529 2.819 . . . . 0.0 111.578 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -67.21 -26.01 42.56 Favored 'Trans proline' 0 CA--C 1.55 1.321 0 C-N-CA 122.367 2.045 . . . . 0.0 115.928 167.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.66 162.9 39.13 Favored 'Trans proline' 0 C--N 1.362 1.245 0 CA-C-N 123.954 2.448 . . . . 0.0 112.834 177.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -62.12 140.72 85.46 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.066 2.51 . . . . 0.0 111.827 171.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -52.32 -42.09 63.55 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.634 0.73 . . . . 0.0 112.221 171.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.542 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.7 pt? -84.76 19.22 2.11 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.604 1.962 . . . . 0.0 114.873 179.287 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -34.49 101.5 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.411 2.285 . . . . 0.0 115.548 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.64 29.1 0.14 Allowed Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.058 0.837 . . . . 0.0 114.498 -171.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.04 156.93 59.17 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 125.264 1.426 . . . . 0.0 111.692 -176.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -73.01 169.5 22.05 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.3 2.666 . . . . 0.0 112.777 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -54.12 -38.89 65.92 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.455 1.102 . . . . 0.0 113.423 -177.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.88 -39.24 68.5 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.523 1.529 . . . . 0.0 112.65 174.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.4 t -81.49 -39.63 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 124.899 1.28 . . . . 0.0 111.662 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 49.1 t -55.22 -40.95 58.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.881 0.872 . . . . 0.0 110.847 176.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -60.45 -50.66 72.68 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.929 -1.107 . . . . 0.0 112.378 175.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.24 -48.0 77.36 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.822 0.849 . . . . 0.0 111.855 177.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -50.73 59.46 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.094 0.958 . . . . 0.0 112.025 169.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.51 -47.38 86.4 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.968 0.804 . . . . 0.0 112.362 -177.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -66.48 -32.37 73.69 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.321 0.648 . . . . 0.0 112.096 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.6 tp -66.53 -49.08 67.67 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.563 0.745 . . . . 0.0 112.109 169.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.25 -25.13 68.18 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.526 1.53 . . . . 0.0 114.496 177.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -53.17 -33.11 51.16 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 119.888 1.222 . . . . 0.0 113.734 173.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.47 -38.81 65.31 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.296 1.038 . . . . 0.0 112.955 169.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -97.49 19.44 13.36 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.02 1.328 . . . . 0.0 113.096 -175.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.06 -19.83 63.33 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.323 -1.486 . . . . 0.0 114.395 -176.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.28 8.02 21.3 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 126.322 1.849 . . . . 0.0 113.002 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.5 mptt -75.8 178.97 5.76 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 120.638 -1.289 . . . . 0.0 111.658 176.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.09 171.27 7.47 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.441 1.897 . . . . 0.0 111.011 176.272 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -45.97 -59.08 5.19 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.825 1.65 . . . . 0.0 112.785 174.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.42 -38.57 19.46 Favored 'Trans proline' 0 C--N 1.357 1.016 0 C-N-CA 122.312 2.008 . . . . 0.0 112.613 178.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.26 -41.87 97.66 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.121 -0.987 . . . . 0.0 112.117 -177.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 12.1 mt -69.43 -51.45 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.103 0.961 . . . . 0.0 110.213 171.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -51.0 -38.08 49.03 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.05 0.841 . . . . 0.0 112.502 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.01 -60.3 3.64 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.383 1.473 . . . . 0.0 111.643 -179.081 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -64.08 -37.4 87.3 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.216 0.606 . . . . 0.0 112.19 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.719 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.1 mm? -64.68 -50.61 66.36 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.641 0.776 . . . . 0.0 110.93 174.273 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -56.85 -37.97 72.04 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 118.949 0.795 . . . . 0.0 113.014 176.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.07 -50.8 65.95 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -178.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.719 ' HE1' HD13 ' A' ' 40' ' ' LEU . 9.4 p-90 -73.53 -36.38 65.69 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 170.39 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.419 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.7 OUTLIER -56.89 -32.88 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.086 1.354 . . . . 0.0 112.118 175.977 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -59.73 -16.39 26.99 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.663 0.785 . . . . 0.0 112.538 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.8 m -102.01 -15.9 16.64 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.172 1.389 . . . . 0.0 112.607 177.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.638 HD11 ' CH2' ' A' ' 43' ' ' TRP . 15.2 mt -60.59 -56.22 23.92 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 177.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -179.11 -159.07 22.66 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 123.715 0.674 . . . . 0.0 112.572 -168.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -123.9 20.9 7.13 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 126.041 1.782 . . . . 0.0 114.383 -175.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -106.92 -38.16 6.13 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.938 1.695 . . . . 0.0 111.484 171.191 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.7 m-85 -71.88 -25.33 61.89 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.563 0.745 . . . . 0.0 112.389 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -54.1 -34.51 60.4 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 172.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.42 -45.61 72.12 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.698 0.799 . . . . 0.0 111.883 177.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -54.72 -46.32 74.19 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 118.544 -0.741 . . . . 0.0 110.632 169.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -57.79 -46.11 85.08 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 119.433 1.015 . . . . 0.0 113.716 175.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -58.27 -42.08 85.69 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.264 0.938 . . . . 0.0 111.225 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.39 -35.47 58.6 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -178.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -64.56 -52.01 59.84 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 125.036 1.334 . . . . 0.0 111.532 174.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.6 ttpp -50.18 -53.12 30.04 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.97 0.908 . . . . 0.0 112.069 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 27.1 pttt -60.92 -46.56 90.17 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 174.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -56.61 -49.37 75.14 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.221 1.008 . . . . 0.0 112.445 177.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.4 -52.36 58.6 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.572 1.549 . . . . 0.0 113.141 176.638 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -55.07 -34.83 63.94 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 118.585 -0.722 . . . . 0.0 112.143 173.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.27 -51.61 29.2 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.067 0.849 . . . . 0.0 111.778 178.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -58.62 -49.32 77.91 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.899 0.879 . . . . 0.0 111.469 176.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -64.3 -50.03 69.45 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.609 1.163 . . . . 0.0 112.2 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.03 -44.48 91.75 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.177 0.898 . . . . 0.0 111.87 176.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -65.07 -50.42 66.23 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.465 0.706 . . . . 0.0 111.882 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -53.72 -51.2 64.06 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.438 1.095 . . . . 0.0 110.557 172.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.05 -41.04 95.84 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.802 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.86 -50.65 72.96 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.338 1.055 . . . . 0.0 111.999 176.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.42 -47.76 84.28 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.754 0.822 . . . . 0.0 112.635 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -59.68 -51.14 71.06 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.944 0.897 . . . . 0.0 110.687 177.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -46.71 68.14 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.401 1.88 . . . . 0.0 112.968 174.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -54.79 -52.57 62.21 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.187 0.995 . . . . 0.0 112.388 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.99 -30.45 69.71 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 177.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 73.8 t -72.97 -22.57 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.808 1.643 . . . . 0.0 113.153 176.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.65 -30.53 63.44 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 176.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -87.53 0.17 55.96 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.295 1.438 . . . . 0.0 114.554 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.9 tpp -97.09 -162.12 0.93 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.193 1.797 . . . . 0.0 111.844 -177.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -53.41 154.85 5.7 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 126.768 2.027 . . . . 0.0 113.546 171.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -70.13 -43.99 2.06 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.389 2.726 . . . . 0.0 112.41 -177.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -62.45 -28.09 69.57 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.018 0.927 . . . . 0.0 113.26 176.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.33 -48.61 79.05 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.877 -0.514 . . . . 0.0 110.981 177.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.34 -41.26 60.45 Favored 'General case' 0 N--CA 1.482 1.158 0 O-C-N 121.492 -0.755 . . . . 0.0 111.678 173.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.413 ' HB3' ' HB1' ' A' ' 106' ' ' ALA . 66.0 mmtt -61.75 -50.32 72.87 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.484 1.514 . . . . 0.0 111.433 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.93 -46.09 89.43 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-O 121.938 0.875 . . . . 0.0 113.079 177.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -65.75 -41.12 92.5 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 120.729 -1.232 . . . . 0.0 112.369 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.62 -38.89 89.28 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 117.826 -1.083 . . . . 0.0 112.277 171.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.61 ' HB2' HD13 ' A' ' 103' ' ' ILE . 6.6 tm-20 -55.24 -53.36 56.99 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.355 1.434 . . . . 0.0 111.593 170.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.14 -36.2 83.26 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-O 121.159 0.504 . . . . 0.0 112.061 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.5 t -73.49 -40.64 63.94 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.188 -0.945 . . . . 0.0 112.403 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.68 -49.48 58.65 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 117.901 -1.047 . . . . 0.0 109.433 174.385 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.1 tp -66.48 -29.66 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 119.873 1.215 . . . . 0.0 113.241 -175.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.15 -17.11 62.56 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 173.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -109.82 -28.26 8.87 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.852 1.661 . . . . 0.0 113.146 -178.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.53 147.02 24.0 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 127.363 2.265 . . . . 0.0 111.767 178.183 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -102.92 -44.96 5.1 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.924 1.29 . . . . 0.0 112.953 170.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t -124.05 -5.07 7.93 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.05 84.27 5.81 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.726 1.61 . . . . 0.0 110.914 -176.572 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 14.1 p30 -65.12 169.42 5.5 Favored 'General case' 0 CA--C 1.55 0.944 0 O-C-N 121.048 -1.032 . . . . 0.0 112.156 175.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 158.95 -12.41 0.2 Allowed Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.093 0.854 . . . . 0.0 114.411 -178.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.61 HD13 ' HB2' ' A' ' 90' ' ' GLU . 1.8 tp -54.54 -48.17 70.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-N 118.691 1.246 . . . . 0.0 112.184 168.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -43.48 -45.9 6.63 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -55.96 -59.4 4.96 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.876 1.27 . . . . 0.0 111.237 171.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.413 ' HB1' ' HB3' ' A' ' 86' ' ' LYS . . . -57.09 -38.28 73.11 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.177 0.991 . . . . 0.0 113.411 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.33 -49.16 78.71 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 126.327 1.851 . . . . 0.0 111.031 174.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.5 mttm -54.69 -48.2 72.72 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.046 -0.978 . . . . 0.0 111.6 173.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.6 mm -56.67 -48.66 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 CA-C-N 119.026 0.83 . . . . 0.0 111.462 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -58.73 -47.52 84.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.188 0.449 . . . . 0.0 111.579 177.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.81 -49.03 79.11 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.153 1.381 . . . . 0.0 112.075 -176.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.8 pt -68.81 -29.56 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 121.385 -0.822 . . . . 0.0 111.909 173.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -71.67 -30.92 66.25 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.529 1.059 . . . . 0.0 113.495 176.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.466 ' HG3' HG23 ' A' ' 115' ' ' THR . 6.2 ptmt -83.97 -16.95 42.2 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 119.278 0.944 . . . . 0.0 113.305 172.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.466 HG23 ' HG3' ' A' ' 114' ' ' LYS . 71.1 p -121.48 20.69 11.14 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.873 1.669 . . . . 0.0 113.869 -177.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.75 151.16 0.63 Allowed Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 126.934 2.093 . . . . 0.0 114.051 176.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -66.84 157.09 63.04 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 121.81 1.673 . . . . 0.0 111.737 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 29.2 tp60 -63.58 -23.7 67.5 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.367 -0.833 . . . . 0.0 112.219 177.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.1 t -61.86 -51.52 67.88 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.2 1.4 . . . . 0.0 112.184 178.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.9 p -69.06 -37.02 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 O-C-N 121.72 -0.612 . . . . 0.0 111.561 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -60.22 -47.89 84.07 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.917 173.066 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -68.3 -39.66 81.98 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.458 1.027 . . . . 0.0 112.928 177.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.61 -37.09 82.03 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.097 -1.002 . . . . 0.0 112.246 177.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.89 -20.13 29.51 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.309 1.044 . . . . 0.0 113.571 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.95 -33.8 57.87 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.001 1.72 . . . . 0.0 112.574 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.53 -36.89 68.42 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.626 1.171 . . . . 0.0 112.365 173.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -75.42 -163.06 11.76 Favored Glycine 0 CA--C 1.538 1.517 0 C-N-CA 126.633 2.063 . . . . 0.0 113.427 172.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -136.25 64.64 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 125.426 1.491 . . . . 0.0 111.946 -167.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 49.67 74.82 0.24 Allowed Glycine 0 CA--C 1.54 1.63 0 C-N-CA 125.646 1.593 . . . . 0.0 113.413 -176.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -69.84 164.93 32.77 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.469 2.779 . . . . 0.0 112.548 -176.149 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -149.74 108.19 3.8 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.073 1.349 . . . . 0.0 110.736 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 7.0 t -126.31 75.71 73.14 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.878 1.271 . . . . 0.0 109.805 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -71.18 176.19 8.19 Favored 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.509 2.806 . . . . 0.0 112.124 174.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 . . . . . 0 C--O 1.253 1.272 0 C-N-CA 124.417 1.087 . . . . 0.0 112.798 173.423 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 123.026 1.393 . . . . 0.0 114.333 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -148.61 130.61 15.31 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.266 1.826 . . . . 0.0 110.908 178.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -63.46 158.83 55.57 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 124.196 0.998 . . . . 0.0 112.082 171.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -66.89 164.95 27.69 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.856 2.371 . . . . 0.0 111.579 178.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -64.41 115.65 3.31 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 122.99 2.46 . . . . 0.0 111.419 175.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -71.95 -20.47 25.6 Favored 'Trans proline' 0 CA--C 1.55 1.28 0 CA-C-O 115.652 -1.895 . . . . 0.0 116.121 167.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.36 166.5 29.1 Favored 'Trans proline' 0 C--N 1.363 1.303 0 CA-C-N 124.427 2.617 . . . . 0.0 112.219 176.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -59.16 132.37 46.58 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.859 2.372 . . . . 0.0 111.361 169.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -49.82 -46.47 51.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.273 0.629 . . . . 0.0 110.848 169.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.727 HD13 ' H ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -93.4 35.44 1.1 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.93 2.492 . . . . 0.0 113.785 -179.606 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.12 110.75 0.19 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.497 1.519 . . . . 0.0 113.864 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.46 18.08 0.28 Allowed Glycine 0 CA--C 1.539 1.588 0 C-N-CA 125.453 1.501 . . . . 0.0 115.717 -174.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.4 160.84 38.09 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 125.857 1.663 . . . . 0.0 112.667 -170.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.09 170.35 20.58 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.504 2.803 . . . . 0.0 113.298 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -53.75 -35.24 61.02 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -179.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.49 -40.53 65.44 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.325 1.45 . . . . 0.0 112.692 173.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.5 t -81.45 -45.27 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 C-N-CA 125.398 1.479 . . . . 0.0 112.203 174.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 92.8 t -54.64 -38.6 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 123.573 0.749 . . . . 0.0 111.07 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -63.35 -50.6 69.35 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.202 -0.936 . . . . 0.0 112.084 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.41 -48.65 71.37 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.018 0.827 . . . . 0.0 112.356 176.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.11 -53.69 39.47 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.719 1.208 . . . . 0.0 111.597 171.146 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -62.96 -47.52 82.82 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -59.33 -41.36 88.96 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.583 1.153 . . . . 0.0 110.888 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 tp -60.91 -52.01 66.84 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 122.575 0.35 . . . . 0.0 111.306 169.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.45 -33.78 68.3 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 178.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -55.14 -35.16 64.43 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 120.449 1.477 . . . . 0.0 113.319 177.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -72.81 -25.26 61.08 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.993 1.317 . . . . 0.0 113.277 172.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -109.83 14.11 23.31 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 126.216 1.806 . . . . 0.0 113.488 -174.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -21.05 60.18 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.289 -1.507 . . . . 0.0 113.814 -171.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.6 p -109.22 2.47 20.95 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.474 2.31 . . . . 0.0 114.316 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -76.56 170.81 15.72 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.064 1.745 . . . . 0.0 111.906 176.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.404 HG22 ' H ' ' A' ' 33' ' ' ASP . 0.2 OUTLIER -84.51 172.02 12.02 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.768 1.227 . . . . 0.0 112.307 173.7 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.404 ' H ' HG22 ' A' ' 32' ' ' THR . 21.6 t0 -49.45 -63.5 1.66 Allowed Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 127.294 2.238 . . . . 0.0 112.302 173.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -62.21 -32.47 82.57 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 122.755 2.303 . . . . 0.0 113.328 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -64.65 -51.16 64.04 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.679 0.792 . . . . 0.0 111.885 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 50.8 mt -64.74 -52.52 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 124.291 1.036 . . . . 0.0 110.028 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -47.7 -52.05 19.69 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.25 1.82 . . . . 0.0 112.706 178.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -57.71 -44.29 85.8 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.306 0.957 . . . . 0.0 112.702 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.67 -43.29 97.13 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.191 0.997 . . . . 0.0 112.67 174.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.74 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.7 mm? -58.72 -48.98 79.28 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.19 1.396 . . . . 0.0 111.75 173.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -62.95 -37.66 87.96 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 177.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.3 -48.87 73.47 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.74 ' HE1' HD13 ' A' ' 40' ' ' LEU . 7.2 p-90 -73.88 -34.0 64.26 Favored 'General case' 0 CA--C 1.553 1.078 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 173.154 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.46 HG23 HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -57.82 -32.46 43.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 124.724 1.21 . . . . 0.0 112.485 173.935 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.39 -15.78 29.4 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 118.677 0.671 . . . . 0.0 112.733 177.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 42.2 m -94.57 -21.44 18.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.947 1.299 . . . . 0.0 113.057 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.577 HD11 ' CH2' ' A' ' 43' ' ' TRP . 24.9 mt -59.4 -63.33 1.34 Allowed 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.23 93.31 0.41 Allowed Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.031 0.824 . . . . 0.0 112.485 -178.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 178.61 -163.5 31.39 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 124.962 1.268 . . . . 0.0 112.22 -177.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -57.37 -16.82 10.01 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.612 1.165 . . . . 0.0 113.911 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -54.18 -21.3 8.52 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.942 2.097 . . . . 0.0 113.887 172.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -36.03 66.78 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.837 1.655 . . . . 0.0 113.904 170.125 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.78 -39.87 84.03 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.933 0.873 . . . . 0.0 110.803 175.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.24 -39.66 87.49 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 117.513 -1.232 . . . . 0.0 112.31 169.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -60.23 -54.08 50.02 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 121.069 1.759 . . . . 0.0 113.09 171.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -58.59 -40.34 82.93 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.57 -0.706 . . . . 0.0 111.561 -177.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.07 -31.72 58.92 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 177.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -51.87 64.43 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.392 1.477 . . . . 0.0 111.132 171.496 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.9 ttmm -53.91 -50.03 67.3 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.267 0.354 . . . . 0.0 110.427 -175.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.3 mttt -62.04 -49.46 75.92 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.552 1.141 . . . . 0.0 113.746 172.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -52.18 -50.92 60.91 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.491 1.496 . . . . 0.0 112.114 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 13.2 mmt -73.84 -45.14 52.98 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.97 -35.24 70.91 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.373 0.533 . . . . 0.0 112.011 173.303 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.65 -50.59 35.12 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.754 1.222 . . . . 0.0 111.263 176.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.8 tptt -55.74 -53.26 58.8 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.783 0.719 . . . . 0.0 110.351 177.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -60.04 -51.73 68.41 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.923 1.289 . . . . 0.0 111.991 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.16 -45.8 93.15 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.599 1.09 . . . . 0.0 113.081 177.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -65.64 -46.65 78.42 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.731 0.813 . . . . 0.0 111.721 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 48.7 mt -57.69 -51.13 70.8 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.365 1.066 . . . . 0.0 111.014 172.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.52 88.62 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.705 0.802 . . . . 0.0 112.142 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -59.43 -50.92 72.08 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.329 1.052 . . . . 0.0 112.277 176.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.91 -47.88 84.37 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.835 0.854 . . . . 0.0 112.775 176.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -55.98 -54.21 47.61 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.844 0.858 . . . . 0.0 111.367 173.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.35 -42.27 77.49 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 119.75 1.159 . . . . 0.0 112.781 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -52.49 64.23 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.416 1.086 . . . . 0.0 112.559 171.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.91 -30.72 70.95 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 176.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 52.9 t -73.09 -25.06 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 126.407 1.883 . . . . 0.0 113.003 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.91 -30.86 66.24 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 177.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.7 pttt -86.68 0.2 55.04 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.168 1.387 . . . . 0.0 114.277 173.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.7 ttm -102.3 -160.3 0.78 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.67 1.988 . . . . 0.0 111.822 -173.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.18 156.12 22.47 Favored Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 125.391 1.476 . . . . 0.0 113.757 177.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.06 -46.19 1.62 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.415 2.743 . . . . 0.0 112.858 -176.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.71 -32.22 70.32 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.153 0.981 . . . . 0.0 112.463 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.72 -49.0 72.56 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.231 0.613 . . . . 0.0 109.96 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -54.33 -43.47 71.25 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 118.564 -0.731 . . . . 0.0 111.464 173.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -59.25 -54.71 43.76 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.255 0.934 . . . . 0.0 110.871 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.77 -49.01 79.24 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 177.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -70.37 -35.79 73.74 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.93 -44.71 88.6 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.906 1.23 . . . . 0.0 111.24 172.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -44.66 82.55 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.824 0.85 . . . . 0.0 111.883 172.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.73 -36.49 83.75 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 121.504 -0.748 . . . . 0.0 112.721 173.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.1 t -72.22 -37.63 69.16 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.786 -1.196 . . . . 0.0 112.644 -177.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -71.08 -51.4 25.4 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 118.911 -0.566 . . . . 0.0 110.032 173.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.5 tt -63.41 -29.77 48.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-N 119.111 0.869 . . . . 0.0 112.881 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.43 -24.2 63.3 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 177.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -110.68 -26.19 9.55 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.473 1.109 . . . . 0.0 113.758 170.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -111.3 81.04 1.38 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.665 1.586 . . . . 0.0 112.078 -174.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -13.11 48.85 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.933 1.293 . . . . 0.0 114.48 176.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 62.2 m -70.64 -18.28 62.86 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 176.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 22.4 mt -85.76 84.21 7.63 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.569 1.148 . . . . 0.0 109.874 176.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 51.6 m-20 -88.6 155.7 19.47 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.874 0.87 . . . . 0.0 111.459 172.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 74.96 12.83 83.07 Favored Glycine 0 CA--C 1.534 1.239 0 CA-C-O 118.964 -0.909 . . . . 0.0 115.223 -178.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.473 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.2 OUTLIER -58.42 -24.23 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 CA-C-N 119.312 1.556 . . . . 0.0 113.361 -174.085 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -47.49 -36.7 10.58 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.56 1.144 . . . . 0.0 113.283 171.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.9 mttt -60.47 -59.42 5.43 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.028 0.831 . . . . 0.0 111.238 173.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.473 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.55 -37.44 87.55 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.036 0.835 . . . . 0.0 111.942 -175.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.6 tm0? -53.27 -51.66 61.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.2 1.0 . . . . 0.0 110.892 171.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -59.51 -49.22 78.62 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 118.05 -0.976 . . . . 0.0 112.57 176.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 33.9 mm -50.74 -48.57 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.64 1.176 . . . . 0.0 110.947 174.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -66.8 -43.26 84.32 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 121.286 -0.884 . . . . 0.0 112.194 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.51 -42.52 92.43 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.524 1.129 . . . . 0.0 112.636 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.7 pp -74.86 -40.12 45.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 121.685 -0.634 . . . . 0.0 111.861 172.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -59.41 -29.87 68.06 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.731 1.213 . . . . 0.0 113.427 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.3 -17.94 14.39 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 175.109 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.9 t -59.46 -21.81 60.61 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.999 1.32 . . . . 0.0 113.55 177.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 40.6 mt -54.92 152.09 14.37 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.081 1.353 . . . . 0.0 112.736 174.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.04 156.18 66.8 Favored 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 122.528 2.152 . . . . 0.0 112.584 -176.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -59.22 -22.09 60.52 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 11.2 t -64.17 -51.7 62.56 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.538 1.063 . . . . 0.0 111.793 174.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.9 p -73.88 -38.01 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 O-C-N 121.7 -0.625 . . . . 0.0 111.502 178.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 mmmt -58.11 -49.5 76.73 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 118.521 -0.752 . . . . 0.0 111.896 172.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -68.2 -39.3 82.48 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.701 1.137 . . . . 0.0 113.388 178.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -67.23 -34.72 78.06 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.474 1.034 . . . . 0.0 112.641 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.51 -21.4 26.98 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.095 0.958 . . . . 0.0 113.148 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.11 -14.97 4.45 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.392 1.477 . . . . 0.0 113.909 177.309 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.421 ' HA ' ' HE2' ' A' ' 126' ' ' LYS . 2.3 mmpt? -62.79 -17.86 61.81 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 167.221 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -110.27 93.2 0.73 Allowed Glycine 0 CA--C 1.534 1.242 0 C-N-CA 126.005 1.764 . . . . 0.0 112.847 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -130.59 60.26 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.695 1.598 . . . . 0.0 112.623 -174.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 54.01 74.96 0.26 Allowed Glycine 0 CA--C 1.541 1.661 0 C-N-CA 125.469 1.509 . . . . 0.0 113.283 -177.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -70.9 92.45 0.62 Allowed 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 124.35 3.367 . . . . 0.0 113.216 -171.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -163.56 121.87 1.94 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 127.481 2.312 . . . . 0.0 109.962 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 42.8 t -116.47 130.16 24.71 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 125.786 1.634 . . . . 0.0 110.028 176.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -70.94 170.3 18.33 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.442 2.761 . . . . 0.0 112.914 178.031 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 . . . . . 0 C--O 1.254 1.304 0 C-N-CA 124.6 1.16 . . . . 0.0 112.819 179.205 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 . . . . . 0 CA--C 1.545 0.758 0 CA-C-O 121.312 0.577 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -152.12 117.5 5.3 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 125.011 1.324 . . . . 0.0 109.717 176.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -61.28 155.85 54.47 Favored Pre-proline 0 N--CA 1.472 0.638 0 C-N-CA 123.39 0.676 . . . . 0.0 111.955 171.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -68.77 170.4 15.43 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 123.052 2.501 . . . . 0.0 112.379 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -64.84 116.19 3.68 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.03 2.487 . . . . 0.0 111.491 176.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -70.32 -22.53 29.39 Favored 'Trans proline' 0 CA--C 1.552 1.402 0 CA-C-O 115.727 -1.864 . . . . 0.0 115.817 163.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.93 169.32 19.4 Favored 'Trans proline' 0 C--N 1.363 1.309 0 CA-C-N 124.222 2.544 . . . . 0.0 112.484 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -59.86 129.3 29.95 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.398 2.065 . . . . 0.0 110.357 171.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -47.67 -47.86 29.29 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.141 0.576 . . . . 0.0 110.964 170.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.755 HD13 ' H ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -91.56 38.77 0.99 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 128.997 2.919 . . . . 0.0 114.242 177.293 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.5 112.69 0.41 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.511 1.125 . . . . 0.0 113.609 174.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 143.65 -12.86 2.21 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.958 1.742 . . . . 0.0 114.616 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.31 161.29 75.45 Favored Pre-proline 0 CA--C 1.558 1.281 0 C-N-CA 125.342 1.457 . . . . 0.0 113.706 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -75.7 172.72 15.77 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.913 3.075 . . . . 0.0 113.675 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -53.31 -37.76 62.56 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.851 1.261 . . . . 0.0 113.821 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -53.24 -41.14 65.14 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.024 1.33 . . . . 0.0 112.696 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.6 t -80.47 -42.23 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 124.599 1.16 . . . . 0.0 111.983 174.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -54.81 -39.31 47.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-N 118.593 0.633 . . . . 0.0 110.688 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.3 tptm -61.16 -50.65 72.29 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.079 -1.013 . . . . 0.0 112.137 174.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.6 -50.4 68.15 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.177 0.591 . . . . 0.0 111.816 176.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.44 -50.58 59.47 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.807 0.843 . . . . 0.0 111.9 170.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.15 -47.45 85.86 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.285 0.948 . . . . 0.0 112.819 -176.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -70.96 -32.28 69.1 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.949 -0.47 . . . . 0.0 111.899 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.3 tp -64.35 -49.15 72.81 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.775 0.83 . . . . 0.0 111.516 170.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -66.53 -29.51 69.62 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.926 1.29 . . . . 0.0 114.448 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.6 mttm -54.7 -51.84 64.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 120.062 1.301 . . . . 0.0 112.833 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.95 -17.93 64.59 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.561 1.144 . . . . 0.0 113.687 173.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -108.79 18.65 20.55 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.543 1.937 . . . . 0.0 113.693 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.09 -20.46 65.98 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 120.18 -1.575 . . . . 0.0 113.512 -176.441 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -103.51 6.76 37.65 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 126.859 2.064 . . . . 0.0 112.991 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -73.73 -172.55 1.28 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.503 1.521 . . . . 0.0 112.704 173.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 m -123.48 170.44 10.38 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 128.098 2.559 . . . . 0.0 110.453 -178.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.7 -56.78 7.89 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.849 1.659 . . . . 0.0 112.637 175.398 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -68.82 -41.99 5.03 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.212 1.941 . . . . 0.0 113.072 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.53 -41.56 94.68 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.379 -1.451 . . . . 0.0 112.654 -178.218 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 64.3 mt -69.46 -53.43 24.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 123.588 0.755 . . . . 0.0 109.641 174.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -58.63 -35.39 72.42 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.037 0.835 . . . . 0.0 111.662 -174.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -54.31 -60.9 2.72 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.337 1.455 . . . . 0.0 112.579 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.6 -36.88 85.26 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.074 0.549 . . . . 0.0 112.078 -178.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.594 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.4 mm? -63.06 -48.97 76.39 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.437 1.095 . . . . 0.0 111.574 174.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -65.23 -34.13 77.63 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 121.568 -0.708 . . . . 0.0 112.363 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.22 -50.87 66.12 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.454 -0.779 . . . . 0.0 112.574 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.594 ' HE1' HD13 ' A' ' 40' ' ' LEU . 7.8 p-90 -73.88 -31.33 63.08 Favored 'General case' 0 CA--C 1.557 1.249 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 170.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.499 HG23 HD12 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -59.46 -32.48 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 O-C-N 120.243 -1.536 . . . . 0.0 111.813 174.136 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -59.2 -18.62 38.23 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.583 -0.698 . . . . 0.0 112.366 176.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -97.61 -13.59 21.48 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.861 1.264 . . . . 0.0 113.237 177.005 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.549 HD11 ' CH2' ' A' ' 43' ' ' TRP . 22.0 mt -62.22 -64.75 0.83 Allowed 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.048 0.84 . . . . 0.0 112.667 174.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.4 117.37 2.64 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.378 0.99 . . . . 0.0 111.657 -177.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 157.22 -169.2 34.23 Favored Glycine 0 CA--C 1.529 0.954 0 C-N-CA 124.922 1.249 . . . . 0.0 112.575 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -59.4 -15.36 16.42 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.336 1.054 . . . . 0.0 113.313 176.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -50.37 -29.38 9.89 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.697 1.999 . . . . 0.0 113.997 174.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.08 -35.8 64.95 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.163 1.385 . . . . 0.0 114.129 172.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.4 -39.54 81.63 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.122 -0.986 . . . . 0.0 111.209 175.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.06 -33.08 75.18 Favored 'General case' 0 C--O 1.22 -0.466 0 O-C-N 121.742 -0.599 . . . . 0.0 110.473 176.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -63.19 -53.22 56.6 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 121.484 -0.76 . . . . 0.0 111.534 173.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.59 -40.56 79.32 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -177.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.3 t -72.17 -39.14 68.89 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -61.52 -52.33 64.93 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.394 -0.816 . . . . 0.0 111.952 176.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 3.3 ttmm -47.88 -46.27 31.33 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 118.329 0.513 . . . . 0.0 111.197 177.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -60.1 -57.17 13.99 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.012 1.325 . . . . 0.0 113.591 173.197 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -54.16 -49.75 68.57 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.302 0.956 . . . . 0.0 112.301 178.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.02 -48.53 73.58 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.383 1.073 . . . . 0.0 112.075 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -54.73 -39.99 68.8 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.517 0.727 . . . . 0.0 111.556 172.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.25 -51.17 56.34 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.798 0.726 . . . . 0.0 111.454 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -60.35 -48.16 82.96 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.73 0.812 . . . . 0.0 111.027 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -61.24 -49.83 75.53 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.067 1.347 . . . . 0.0 112.089 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.82 -51.63 68.22 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.788 1.176 . . . . 0.0 112.86 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -62.78 -48.36 79.49 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.811 -0.556 . . . . 0.0 112.465 178.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.1 tp -54.46 -51.24 65.63 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.184 0.994 . . . . 0.0 110.955 174.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.78 -42.92 99.61 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.581 1.152 . . . . 0.0 112.072 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -58.17 -50.84 72.11 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.824 1.193 . . . . 0.0 111.466 174.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.34 -47.86 80.42 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.762 0.825 . . . . 0.0 112.713 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -54.5 -56.29 20.37 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.209 1.004 . . . . 0.0 111.068 172.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.82 -40.81 73.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.519 1.128 . . . . 0.0 113.205 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.51 -52.54 65.2 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 171.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.19 -29.76 70.09 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 176.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.6 t -73.13 -26.66 23.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 125.868 1.667 . . . . 0.0 112.678 175.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.56 -34.32 64.64 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.5 pttt -85.03 1.71 46.46 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.286 1.435 . . . . 0.0 114.347 175.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.7 ttm -103.25 -159.27 0.71 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.985 2.114 . . . . 0.0 111.695 -174.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.74 156.71 11.81 Favored Pre-proline 0 N--CA 1.479 1.003 0 C-N-CA 125.283 1.433 . . . . 0.0 113.864 176.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.43 -45.54 1.73 Allowed 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.448 2.765 . . . . 0.0 112.803 -177.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -61.3 -30.71 70.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.147 0.979 . . . . 0.0 112.438 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.76 -48.44 71.82 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.837 0.455 . . . . 0.0 110.23 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.19 -44.62 68.07 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.385 173.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm -59.53 -54.77 42.68 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.034 0.833 . . . . 0.0 110.863 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.08 -49.14 78.81 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.698 -0.626 . . . . 0.0 112.481 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -66.55 -32.94 74.61 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.05 -46.57 80.68 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.663 1.119 . . . . 0.0 111.577 172.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -56.91 -47.06 81.45 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 118.891 0.769 . . . . 0.0 111.662 172.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.6 tp -63.06 -38.75 92.44 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 176.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 21.7 t -71.13 -42.97 68.52 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.69 -1.256 . . . . 0.0 112.256 -178.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.38 -46.11 70.92 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 118.666 -0.683 . . . . 0.0 110.624 175.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.3 tp -66.47 -33.72 65.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 119.263 0.938 . . . . 0.0 111.717 -178.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.04 -32.77 74.45 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -94.31 -28.14 15.73 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 173.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -132.95 78.1 1.77 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.192 1.397 . . . . 0.0 110.964 -172.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -69.88 -32.26 70.52 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.777 -1.202 . . . . 0.0 112.254 -177.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 12.6 t -73.74 -18.81 60.94 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.421 1.489 . . . . 0.0 113.875 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -94.51 84.44 4.32 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.201 1.0 . . . . 0.0 109.266 178.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -92.33 158.17 16.24 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.995 0.918 . . . . 0.0 110.895 170.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 159.34 -87.05 0.11 Allowed Glycine 0 N--CA 1.468 0.811 0 C-N-CA 124.667 1.127 . . . . 0.0 111.79 178.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.411 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -55.63 -31.72 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 CA-C-N 118.067 0.934 . . . . 0.0 111.889 179.757 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -46.93 -37.72 9.41 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.873 1.269 . . . . 0.0 113.429 -178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -61.1 -59.42 5.37 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.864 0.866 . . . . 0.0 110.947 172.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.411 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -63.81 -33.63 76.1 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.794 0.724 . . . . 0.0 112.285 -177.114 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.07 -50.99 71.96 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.83 1.252 . . . . 0.0 111.426 173.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.9 -48.47 79.79 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.111 0.964 . . . . 0.0 111.03 173.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 18.4 mm -53.31 -50.59 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 124.378 1.071 . . . . 0.0 111.322 176.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -63.13 -44.44 95.56 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.779 1.172 . . . . 0.0 112.887 176.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.81 -49.0 78.1 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.077 0.951 . . . . 0.0 110.784 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.4 pt -70.49 -38.86 75.2 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 CA-C-O 118.243 -0.884 . . . . 0.0 112.629 173.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -58.17 -39.57 79.23 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 121.006 1.73 . . . . 0.0 113.075 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -67.1 -14.76 63.21 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.824 1.25 . . . . 0.0 113.562 173.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.0 t -132.56 33.34 3.79 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.798 2.039 . . . . 0.0 113.513 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 8.9 mt -108.04 74.86 0.51 Allowed Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 126.174 1.789 . . . . 0.0 109.966 175.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.98 168.39 19.01 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.95 2.433 . . . . 0.0 111.904 173.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -60.53 -27.33 67.54 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.401 -0.812 . . . . 0.0 113.036 173.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 65.6 m -60.46 -51.71 68.32 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.435 1.471 . . . . 0.0 112.381 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.461 HG22 HD23 ' A' ' 124' ' ' LEU . 14.8 p -68.56 -40.15 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.811 -0.556 . . . . 0.0 111.638 175.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 mmtt -58.16 -48.1 81.33 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.502 174.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -69.05 -38.17 78.95 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.674 1.125 . . . . 0.0 113.444 177.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -69.29 -37.09 77.66 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.605 1.093 . . . . 0.0 112.326 177.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.461 HD23 HG22 ' A' ' 120' ' ' VAL . 0.5 OUTLIER -85.83 -20.82 28.57 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.682 1.193 . . . . 0.0 113.132 179.413 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.25 -24.1 10.46 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 126.605 1.962 . . . . 0.0 113.601 177.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.6 tptt -55.66 -29.57 59.53 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.178 1.391 . . . . 0.0 113.371 171.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 85.48 -140.71 18.41 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 125.518 1.533 . . . . 0.0 112.844 -176.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -118.98 64.93 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 126.723 2.009 . . . . 0.0 111.042 -170.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 50.08 74.71 0.25 Allowed Glycine 0 CA--C 1.541 1.672 0 C-N-CA 125.871 1.701 . . . . 0.0 113.352 -174.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -68.52 161.88 43.19 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.42 2.746 . . . . 0.0 112.566 -176.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -143.05 97.91 3.18 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.937 1.295 . . . . 0.0 111.197 -177.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 38.8 t -134.85 131.85 20.22 Favored Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 125.339 1.456 . . . . 0.0 110.121 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -69.86 174.7 9.21 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 123.779 2.986 . . . . 0.0 113.081 176.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 . . . . . 0 C--O 1.25 1.124 0 C-N-CA 126.025 1.73 . . . . 0.0 113.299 -179.131 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 26.3 t0 . . . . . 0 N--CA 1.478 0.955 0 CA-C-O 122.334 1.064 . . . . 0.0 111.751 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 63.58 13.81 7.57 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 126.36 1.864 . . . . 0.0 114.202 -176.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p -121.93 160.01 48.93 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 128.418 2.687 . . . . 0.0 111.905 -173.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -67.45 168.78 17.1 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.017 2.478 . . . . 0.0 112.133 176.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -64.79 118.24 5.24 Favored 'Trans proline' 0 CA--C 1.546 1.081 0 C-N-CA 122.602 2.201 . . . . 0.0 111.079 172.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -69.47 -22.8 32.89 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 CA-C-O 115.381 -2.008 . . . . 0.0 115.995 164.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.89 169.9 20.13 Favored 'Trans proline' 0 C--N 1.363 1.333 0 CA-C-N 124.487 2.638 . . . . 0.0 113.451 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -62.21 121.24 9.17 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.18 2.586 . . . . 0.0 111.975 175.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -56.72 -19.14 15.17 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 171.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.401 ' N ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -117.29 36.69 4.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 129.317 3.047 . . . . 0.0 112.415 178.128 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.16 110.89 0.24 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.401 1.48 . . . . 0.0 113.007 175.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.17 13.11 0.2 Allowed Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.916 1.246 . . . . 0.0 115.766 -174.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -116.76 160.02 38.28 Favored Pre-proline 0 CA--C 1.554 1.114 0 C-N-CA 125.663 1.585 . . . . 0.0 112.67 -170.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -73.82 171.4 17.94 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.423 2.749 . . . . 0.0 113.299 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -55.35 -34.01 63.9 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -53.3 -40.71 64.96 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.249 1.42 . . . . 0.0 112.779 171.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 56.0 t -78.75 -44.18 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 124.508 1.123 . . . . 0.0 111.986 173.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 73.7 t -53.91 -39.52 40.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-N 118.816 0.735 . . . . 0.0 111.211 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 tptm -62.78 -50.45 70.99 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.038 -1.038 . . . . 0.0 112.223 174.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.63 -49.24 71.0 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.258 0.623 . . . . 0.0 111.691 176.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.89 -51.19 58.56 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.29 1.036 . . . . 0.0 111.976 170.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.44 -47.3 86.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.881 1.218 . . . . 0.0 113.312 -177.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -65.7 -40.41 92.25 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.895 -0.503 . . . . 0.0 110.979 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.2 tp -61.66 -46.38 89.99 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.862 0.865 . . . . 0.0 111.524 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -63.16 -40.8 98.58 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.714 -1.241 . . . . 0.0 113.8 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.5 mmtp -56.06 -36.0 67.56 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 119.262 0.937 . . . . 0.0 112.974 174.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.68 -38.35 70.64 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.274 1.43 . . . . 0.0 113.497 173.369 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -98.3 20.39 12.65 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.538 1.535 . . . . 0.0 113.168 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -66.67 -17.08 64.66 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 119.813 -1.804 . . . . 0.0 113.923 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.0 p -95.35 2.01 54.51 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 127.312 2.245 . . . . 0.0 114.363 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -84.08 179.42 7.51 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.652 1.581 . . . . 0.0 111.163 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.44 170.8 7.73 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.673 1.989 . . . . 0.0 111.068 177.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -47.78 -58.35 7.89 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 124.987 1.315 . . . . 0.0 112.221 175.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.75 -36.85 17.57 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.044 1.829 . . . . 0.0 114.26 178.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.99 -45.08 96.25 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 120.959 -1.088 . . . . 0.0 111.918 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.8 mt -69.46 -48.53 66.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-O 118.665 -0.683 . . . . 0.0 110.552 175.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -52.31 -41.11 62.68 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.244 0.929 . . . . 0.0 111.249 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.64 -50.75 71.3 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.215 1.406 . . . . 0.0 112.63 177.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.09 -43.31 95.62 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.45 0.7 . . . . 0.0 112.278 176.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.705 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.3 mm? -63.26 -48.54 77.74 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.727 0.811 . . . . 0.0 110.525 175.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -60.41 -31.27 70.22 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 176.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.16 -51.75 68.67 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.437 -0.789 . . . . 0.0 112.072 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.705 ' HE1' HD13 ' A' ' 40' ' ' LEU . 15.8 p-90 -73.84 -31.22 63.1 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 112.986 0.735 . . . . 0.0 112.986 173.037 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.422 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -57.82 -32.89 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 125.6 1.56 . . . . 0.0 112.993 174.45 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -57.77 -15.75 9.1 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.24 -14.84 18.3 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.469 1.507 . . . . 0.0 113.549 176.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.661 HD11 ' CH2' ' A' ' 43' ' ' TRP . 23.4 mt -65.99 -58.04 6.43 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 176.24 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 75.07 44.7 22.69 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 123.803 0.716 . . . . 0.0 114.712 -177.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -124.96 47.83 1.0 Allowed Glycine 0 N--CA 1.475 1.26 0 C-N-CA 126.178 1.847 . . . . 0.0 113.832 -178.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 69.7 -1.94 2.13 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 128.388 2.675 . . . . 0.0 114.328 -175.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -65.09 -21.31 66.79 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.394 1.478 . . . . 0.0 114.307 -178.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.61 -36.38 56.24 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.674 1.59 . . . . 0.0 113.423 173.19 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.48 -43.99 75.75 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.66 0.784 . . . . 0.0 111.511 177.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.83 -42.81 94.38 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 118.441 -0.79 . . . . 0.0 111.635 169.623 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -57.42 -51.87 67.67 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.374 1.443 . . . . 0.0 112.764 175.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.72 -44.85 93.56 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.844 -0.535 . . . . 0.0 112.018 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.2 t -68.35 -38.88 81.91 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 122.816 0.446 . . . . 0.0 112.177 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -66.34 -54.62 22.46 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.729 0.811 . . . . 0.0 111.929 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.7 ttpp -52.82 -43.08 65.71 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.514 0.325 . . . . 0.0 111.48 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.5 mmtt -56.99 -54.3 48.26 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.111 1.764 . . . . 0.0 113.464 170.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -53.48 -46.18 69.9 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.38 0.991 . . . . 0.0 112.499 175.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -61.47 -53.39 57.04 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 121.522 -0.736 . . . . 0.0 112.437 177.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.8 mmtm -55.74 -35.55 66.29 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.2 1.0 . . . . 0.0 111.817 176.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.12 -51.02 42.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.071 0.948 . . . . 0.0 111.034 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.69 -46.4 89.19 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.694 0.798 . . . . 0.0 111.55 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -62.72 -51.71 66.13 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.675 1.19 . . . . 0.0 112.019 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.11 -46.03 86.23 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.039 0.836 . . . . 0.0 112.432 177.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -63.42 -46.67 85.26 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.038 0.935 . . . . 0.0 112.46 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -56.44 -50.97 70.12 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.223 1.009 . . . . 0.0 111.325 171.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.12 -40.47 89.82 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.248 0.619 . . . . 0.0 111.986 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -61.45 -50.23 73.6 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.764 1.226 . . . . 0.0 111.668 175.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.68 -47.05 85.81 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.542 0.61 . . . . 0.0 112.332 177.055 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.433 ' O ' HG23 ' A' ' 77' ' ' VAL . 0.7 OUTLIER -57.24 -53.56 56.71 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.922 0.889 . . . . 0.0 111.26 175.185 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -50.82 -45.69 59.63 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.3 1.44 . . . . 0.0 113.155 174.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.3 -50.87 72.09 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.944 1.298 . . . . 0.0 111.973 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.38 -34.14 77.6 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 172.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 73' ' ' HIS . 72.3 t -72.2 -23.46 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 124.927 1.291 . . . . 0.0 112.578 179.285 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.03 -31.25 60.95 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.68 -1.263 . . . . 0.0 114.382 175.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.93 -2.79 52.55 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.986 1.314 . . . . 0.0 114.298 176.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.21 -160.27 0.79 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.832 2.053 . . . . 0.0 112.036 -174.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -52.57 155.05 4.08 Favored Pre-proline 0 N--CA 1.479 0.985 0 C-N-CA 126.529 1.932 . . . . 0.0 113.485 171.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -67.05 -49.96 1.21 Allowed 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.296 2.664 . . . . 0.0 112.269 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -61.08 -27.76 68.59 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.967 1.307 . . . . 0.0 113.298 178.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.85 -51.96 62.24 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.913 0.485 . . . . 0.0 110.086 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.2 -42.3 66.15 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.265 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.2 mmtm -60.29 -54.73 42.2 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.564 0.62 . . . . 0.0 110.654 -178.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.38 84.04 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.424 0.689 . . . . 0.0 112.788 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.14 -40.51 86.76 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 177.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.96 -48.35 82.05 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.378 1.071 . . . . 0.0 111.074 171.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.63 -43.76 72.55 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.364 1.066 . . . . 0.0 112.057 173.035 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.455 ' HA ' HG22 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -68.79 -34.59 75.8 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 118.893 0.77 . . . . 0.0 112.866 176.332 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.9 t -71.96 -43.73 64.72 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.754 -1.216 . . . . 0.0 113.016 177.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -35.5 68.91 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.316 1.046 . . . . 0.0 111.705 176.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.455 HG22 ' HA ' ' A' ' 91' ' ' LEU . 5.6 tt -73.05 -32.73 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 119.253 0.933 . . . . 0.0 111.906 175.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.36 -16.66 37.27 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -116.86 8.63 13.62 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.713 1.605 . . . . 0.0 113.566 175.132 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.74 136.32 56.8 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.101 -0.999 . . . . 0.0 112.39 175.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -103.07 -46.6 4.59 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.391 1.476 . . . . 0.0 112.916 168.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -124.03 -3.48 8.08 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.638 1.575 . . . . 0.0 114.373 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.69 84.31 4.79 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.361 1.465 . . . . 0.0 110.626 -178.149 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -95.12 160.93 14.33 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.312 1.045 . . . . 0.0 111.68 176.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 76.98 31.78 51.9 Favored Glycine 0 N--CA 1.475 1.237 0 N-CA-C 115.403 0.921 . . . . 0.0 115.403 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.478 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -59.62 -26.96 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 119.339 1.569 . . . . 0.0 113.211 -178.591 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -47.63 -33.87 7.25 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.297 1.439 . . . . 0.0 113.272 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -59.38 -59.57 5.24 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.797 0.839 . . . . 0.0 111.053 171.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.478 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.09 -37.83 88.87 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.19 0.905 . . . . 0.0 111.849 -176.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -53.92 -52.02 61.9 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.67 0.788 . . . . 0.0 111.17 172.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.6 tttt -58.17 -51.78 68.31 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.683 175.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 25.5 mm -49.78 -46.92 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.438 1.095 . . . . 0.0 110.584 178.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -69.16 -42.54 75.78 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.635 0.774 . . . . 0.0 112.795 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.45 -31.99 71.96 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.229 1.412 . . . . 0.0 113.672 174.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 29.3 pt -87.32 -31.31 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 119.113 0.869 . . . . 0.0 112.596 171.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.413 ' OH ' HD11 ' A' ' 124' ' ' LEU . 66.2 t80 -62.86 -35.56 80.37 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.843 -1.16 . . . . 0.0 111.911 176.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.11 -21.01 66.37 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.35 -0.844 . . . . 0.0 112.802 175.273 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 7.3 m -77.9 -26.36 49.04 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.844 1.658 . . . . 0.0 112.55 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 40.1 mt -54.22 152.24 11.71 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 123.467 0.707 . . . . 0.0 112.656 172.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.16 159.02 54.12 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.812 2.341 . . . . 0.0 112.474 -176.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -60.35 -24.34 64.99 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 174.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.3 p -63.93 -51.32 64.96 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.691 1.132 . . . . 0.0 112.019 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.4 p -71.88 -39.31 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.853 -0.529 . . . . 0.0 111.576 176.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -56.71 -51.62 68.1 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 118.607 -0.711 . . . . 0.0 112.001 172.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -67.79 -42.38 81.74 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.578 1.081 . . . . 0.0 112.247 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.83 -35.85 81.28 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.115 -0.991 . . . . 0.0 112.546 176.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.413 HD11 ' OH ' ' A' ' 113' ' ' TYR . 0.5 OUTLIER -90.18 -19.41 24.25 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.113 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -57.23 -27.89 62.42 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.106 1.762 . . . . 0.0 113.065 176.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 49.9 mmtt -93.59 -4.17 51.33 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.156 1.782 . . . . 0.0 114.144 171.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.09 -112.86 0.82 Allowed Glycine 0 CA--C 1.534 1.231 0 C-N-CA 126.66 2.076 . . . . 0.0 111.291 171.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . 0.267 1.0 OUTLIER 29.37 60.4 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 127.774 2.43 . . . . 0.0 114.677 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 56.32 75.5 0.24 Allowed Glycine 0 CA--C 1.541 1.69 0 C-N-CA 125.502 1.525 . . . . 0.0 113.318 -173.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -71.18 110.2 2.77 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 123.711 2.941 . . . . 0.0 112.686 -171.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -161.94 116.24 1.9 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.886 1.675 . . . . 0.0 110.748 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 39.7 t -97.34 131.96 26.34 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 124.834 1.254 . . . . 0.0 110.219 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -70.56 174.61 9.95 Favored 'Trans proline' 0 CA--C 1.545 1.028 0 C-N-CA 123.728 2.952 . . . . 0.0 113.151 176.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 . . . . . 0 C--O 1.253 1.259 0 C-N-CA 125.159 1.383 . . . . 0.0 113.682 176.678 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 . . . . . 0 CA--C 1.551 0.99 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -62.94 -40.17 96.84 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.483 1.513 . . . . 0.0 114.126 178.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.97 158.1 88.3 Favored Pre-proline 0 N--CA 1.474 0.775 0 C-N-CA 124.984 1.314 . . . . 0.0 112.654 173.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -70.06 162.09 43.51 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 122.642 2.228 . . . . 0.0 111.817 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.85 117.88 4.92 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.859 3.039 . . . . 0.0 111.849 -177.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.14 -21.66 26.93 Favored 'Trans proline' 0 CA--C 1.553 1.467 0 C-N-CA 122.591 2.194 . . . . 0.0 116.654 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.4 167.41 25.36 Favored 'Trans proline' 0 C--N 1.361 1.216 0 CA-C-N 124.241 2.55 . . . . 0.0 112.271 176.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.443 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 33.3 Cg_endo -58.27 133.33 54.43 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.803 2.335 . . . . 0.0 111.752 170.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -49.24 -48.68 45.47 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.397 0.679 . . . . 0.0 111.635 171.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.556 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.6 pt? -81.34 18.1 1.2 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 127.128 2.171 . . . . 0.0 115.03 -178.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.36 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.956 2.102 . . . . 0.0 115.467 -172.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.19 24.22 0.1 Allowed Glycine 0 CA--C 1.538 1.502 0 C-N-CA 124.979 1.276 . . . . 0.0 114.758 -173.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -121.76 157.74 56.31 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 125.856 1.662 . . . . 0.0 111.944 -173.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -73.99 169.14 23.11 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.182 2.588 . . . . 0.0 113.205 -177.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -52.09 -41.06 62.1 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.585 1.554 . . . . 0.0 113.275 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -54.22 -42.01 69.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.09 1.356 . . . . 0.0 112.91 173.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.5 t -78.9 -39.24 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.371 1.069 . . . . 0.0 111.503 176.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 46.9 t -57.04 -40.08 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.689 0.795 . . . . 0.0 111.098 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.9 tptt -63.02 -50.63 69.94 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.9 -1.125 . . . . 0.0 111.968 174.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -52.84 -48.42 67.02 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.501 0.72 . . . . 0.0 112.232 174.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.443 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 1.5 t80 -50.66 -53.66 29.24 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.593 1.157 . . . . 0.0 111.964 168.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.35 -47.48 85.86 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.324 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -62.11 -42.87 99.67 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.541 0.736 . . . . 0.0 111.166 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.4 tp -58.25 -47.7 82.75 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.522 0.729 . . . . 0.0 111.258 172.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -64.39 -30.75 71.79 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -57.89 -29.97 65.49 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 120.392 1.451 . . . . 0.0 113.279 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -46.34 68.59 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.613 1.165 . . . . 0.0 112.105 169.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -94.16 17.68 12.17 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.336 1.854 . . . . 0.0 114.046 -174.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.76 -25.03 66.2 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 120.044 -1.66 . . . . 0.0 113.316 -172.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.2 p -87.51 -0.48 56.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.555 1.942 . . . . 0.0 114.284 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -81.15 161.1 24.2 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.13 1.372 . . . . 0.0 112.245 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -87.15 171.28 10.8 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.749 2.02 . . . . 0.0 111.651 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -41.91 -59.75 2.39 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 127.487 2.315 . . . . 0.0 113.237 172.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.402 ' HB3' ' HG3' ' A' ' 62' ' ' MET . 83.4 Cg_endo -74.06 -31.34 7.99 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 122.048 1.832 . . . . 0.0 113.578 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.69 -42.84 90.76 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.874 -1.141 . . . . 0.0 111.76 177.315 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.3 mt -65.97 -53.34 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 123.451 0.7 . . . . 0.0 109.824 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -56.82 -39.16 73.66 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.262 0.937 . . . . 0.0 112.216 -174.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.1 tttm -59.6 -57.41 13.05 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.575 1.15 . . . . 0.0 112.871 177.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -63.18 -38.04 89.6 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.865 -0.522 . . . . 0.0 111.878 -178.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.672 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.0 OUTLIER -63.12 -48.77 77.12 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.62 1.168 . . . . 0.0 111.402 174.27 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.52 -41.19 72.81 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 121.389 -0.819 . . . . 0.0 113.027 173.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.54 -47.56 73.03 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -176.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.675 ' CH2' HD11 ' A' ' 47' ' ' LEU . 7.4 p-90 -73.99 -36.63 64.53 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 114.59 1.329 . . . . 0.0 114.59 168.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.07 -33.37 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 125.363 1.465 . . . . 0.0 112.326 175.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -59.9 -12.42 7.64 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.055 0.942 . . . . 0.0 112.931 177.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.1 m -109.86 -10.7 14.74 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.767 1.627 . . . . 0.0 112.537 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.675 HD11 ' CH2' ' A' ' 43' ' ' TRP . 16.4 mt -66.86 -52.95 37.48 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 173.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -177.06 -166.76 34.49 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 123.678 0.656 . . . . 0.0 112.797 -163.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -123.44 12.08 8.44 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.603 1.573 . . . . 0.0 114.671 -174.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -106.91 -31.45 8.34 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.67 2.388 . . . . 0.0 112.47 173.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -72.78 -22.2 60.87 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.196 0.998 . . . . 0.0 112.698 176.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -33.77 57.85 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.378 1.471 . . . . 0.0 114.359 171.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.1 -40.03 78.62 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.669 0.788 . . . . 0.0 112.074 178.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.19 -46.37 79.42 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 121.15 -0.969 . . . . 0.0 111.173 169.371 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -58.23 -48.66 79.68 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 174.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -57.23 -42.81 82.12 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.89 0.768 . . . . 0.0 111.183 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.22 -37.06 66.56 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.032 0.533 . . . . 0.0 112.395 -179.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.97 -47.82 78.91 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.501 1.12 . . . . 0.0 113.212 176.431 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 19.4 ttpp -56.41 -44.32 80.2 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.965 0.906 . . . . 0.0 111.962 177.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 mttm -58.08 -52.73 64.31 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.639 0.776 . . . . 0.0 112.29 169.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -55.94 -41.64 74.94 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.003 0.82 . . . . 0.0 112.91 177.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.402 ' HG3' ' HB3' ' A' ' 34' ' ' PRO . 9.8 tmm? -61.79 -51.32 68.75 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 121.514 -0.741 . . . . 0.0 112.542 175.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -63.82 -28.6 69.97 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.62 0.368 . . . . 0.0 111.399 177.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.43 -51.46 14.87 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.56 1.144 . . . . 0.0 111.916 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.48 -52.67 64.64 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.464 0.575 . . . . 0.0 110.139 174.118 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.38 -49.19 78.13 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.251 -178.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.36 -46.55 88.15 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.867 1.212 . . . . 0.0 113.064 177.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -66.16 -46.86 75.93 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 118.847 0.749 . . . . 0.0 112.435 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 75.7 mt -57.75 -49.38 76.76 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.463 1.105 . . . . 0.0 110.855 173.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.56 -43.93 96.72 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.188 -0.91 . . . . 0.0 112.233 177.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.7 mtpt -56.21 -50.68 70.57 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.458 1.481 . . . . 0.0 112.421 173.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.49 -51.32 67.92 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 177.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -57.09 -51.99 67.09 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.69 0.796 . . . . 0.0 111.715 175.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.08 -44.62 67.67 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.91 1.284 . . . . 0.0 112.113 176.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -57.18 -52.29 65.9 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.642 0.655 . . . . 0.0 112.583 174.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.31 -30.97 70.95 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 178.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.6 t -72.74 -25.37 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 126.79 2.036 . . . . 0.0 112.913 175.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.44 -30.68 63.15 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.178 1.547 . . . . 0.0 115.178 176.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 pttt -88.73 3.15 51.9 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 125.821 1.648 . . . . 0.0 114.181 172.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 9.1 ttm -106.31 -163.55 0.93 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.695 1.998 . . . . 0.0 111.333 -173.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.15 152.93 20.23 Favored Pre-proline 0 N--CA 1.481 1.091 0 C-N-CA 125.702 1.601 . . . . 0.0 114.209 178.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -68.52 -46.51 1.89 Allowed 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.885 3.057 . . . . 0.0 113.303 -173.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.92 -37.19 71.13 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.411 1.484 . . . . 0.0 112.49 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.0 -46.57 80.88 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.329 0.652 . . . . 0.0 109.828 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -45.39 58.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.418 1.087 . . . . 0.0 111.977 174.291 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -65.85 -51.62 57.34 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.707 1.203 . . . . 0.0 112.069 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.68 -45.2 92.78 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.167 0.987 . . . . 0.0 113.0 177.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.94 -36.93 70.04 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.065 -1.022 . . . . 0.0 113.234 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.79 97.21 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.496 1.044 . . . . 0.0 111.714 171.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -53.97 -50.51 66.37 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.218 1.407 . . . . 0.0 111.625 170.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 9.6 tp -59.53 -39.69 84.72 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 174.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.5 t -72.62 -38.36 67.8 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.189 -0.945 . . . . 0.0 112.684 -175.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -71.26 -48.66 49.67 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.443 0.697 . . . . 0.0 110.833 174.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.7 tt -67.12 -27.71 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.08 -34.48 70.2 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -79.87 -28.3 39.99 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 171.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -149.05 99.23 2.93 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.302 1.041 . . . . 0.0 113.37 -172.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -64.1 -13.98 51.5 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.6 t -77.23 -5.42 49.22 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.984 1.313 . . . . 0.0 114.139 178.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 87.5 mt -71.97 84.4 0.97 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.944 1.298 . . . . 0.0 111.859 177.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -86.36 177.56 7.42 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.463 1.505 . . . . 0.0 112.738 172.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 85.7 -20.86 16.76 Favored Glycine 0 N--CA 1.473 1.132 0 C-N-CA 125.538 1.542 . . . . 0.0 114.9 177.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -61.41 -24.78 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.884 1.274 . . . . 0.0 112.512 177.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -49.47 -35.97 21.28 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.44 1.496 . . . . 0.0 112.975 174.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -57.12 -59.38 5.17 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.595 1.158 . . . . 0.0 111.48 173.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.96 -36.92 85.94 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.582 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.63 -47.25 80.1 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.709 1.204 . . . . 0.0 110.931 174.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.74 -52.41 62.6 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 117.529 -1.224 . . . . 0.0 112.473 168.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 8.9 mm -52.68 -45.23 48.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 CA-C-N 119.705 1.139 . . . . 0.0 111.678 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -67.37 -45.09 77.31 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.043 0.937 . . . . 0.0 112.018 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.84 -47.37 86.65 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.57 1.148 . . . . 0.0 112.132 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -69.05 -38.62 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.879 -0.513 . . . . 0.0 111.986 173.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -63.83 -28.93 70.19 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.181 1.355 . . . . 0.0 112.859 175.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.1 -11.38 48.47 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 120.083 -1.635 . . . . 0.0 114.224 170.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.92 -7.4 52.19 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 173.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 20.6 mt -48.36 149.94 2.52 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.404 1.482 . . . . 0.0 113.137 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -67.04 165.64 25.66 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.062 2.508 . . . . 0.0 113.251 -173.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 68.5 mm-40 -55.43 -27.84 50.5 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.072 0.949 . . . . 0.0 112.722 176.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.24 -51.69 68.7 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.584 1.154 . . . . 0.0 112.707 176.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -70.96 -46.37 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 O-C-N 121.609 -0.682 . . . . 0.0 109.642 175.324 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -58.48 -40.96 84.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 118.936 -1.106 . . . . 0.0 110.023 -173.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -65.54 -46.59 78.98 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.109 1.363 . . . . 0.0 112.712 173.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -37.24 79.01 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 119.591 1.087 . . . . 0.0 112.796 179.078 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.2 pp -89.01 -21.53 23.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.491 0.716 . . . . 0.0 112.825 -179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -58.63 -23.72 59.56 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.814 1.646 . . . . 0.0 113.839 176.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.4 -26.96 44.74 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.945 1.298 . . . . 0.0 112.23 168.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 50.55 -134.69 29.55 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.555 1.074 . . . . 0.0 111.845 -175.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.2 pp -143.22 49.21 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 126.166 1.786 . . . . 0.0 111.8 -174.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 56.81 76.86 0.18 Allowed Glycine 0 CA--C 1.54 1.656 0 C-N-CA 126.63 2.062 . . . . 0.0 112.617 -178.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -73.46 170.89 18.86 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.492 2.795 . . . . 0.0 112.96 -174.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -135.08 74.18 1.51 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.892 1.677 . . . . 0.0 110.927 -177.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 22.9 t -142.65 133.15 12.46 Favored Pre-proline 0 N--CA 1.481 1.082 0 C-N-CA 126.164 1.785 . . . . 0.0 109.581 177.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -72.4 -179.91 4.48 Favored 'Trans proline' 0 CA--C 1.547 1.137 0 C-N-CA 123.821 3.014 . . . . 0.0 113.097 174.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 47.9 tp60 . . . . . 0 C--O 1.252 1.215 0 C-N-CA 125.037 1.335 . . . . 0.0 113.069 177.555 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.545 0.763 0 CA-C-O 120.926 0.394 . . . . 0.0 112.042 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -158.69 55.47 0.43 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.61 1.564 . . . . 0.0 112.609 -176.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.21 162.92 40.43 Favored Pre-proline 0 N--CA 1.478 0.945 0 C-N-CA 124.641 1.176 . . . . 0.0 112.131 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -70.15 118.15 5.52 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 123.161 2.574 . . . . 0.0 110.461 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -75.92 114.78 4.0 Favored 'Trans proline' 0 CA--C 1.547 1.133 0 C-N-CA 122.975 2.45 . . . . 0.0 112.878 -177.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -68.53 -21.85 39.33 Favored 'Trans proline' 0 CA--C 1.554 1.499 0 N-CA-C 116.977 1.876 . . . . 0.0 116.977 170.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.89 166.98 27.22 Favored 'Trans proline' 0 C--N 1.362 1.269 0 CA-C-N 124.264 2.559 . . . . 0.0 112.882 176.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.16 148.08 84.63 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.073 2.516 . . . . 0.0 112.543 175.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -61.18 -24.66 66.47 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.492 HD13 ' H ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -112.57 32.87 5.31 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.869 2.468 . . . . 0.0 111.629 177.621 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.18 116.55 0.84 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.86 1.264 . . . . 0.0 113.148 171.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.99 -11.53 2.85 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 126.362 1.934 . . . . 0.0 113.629 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.97 158.89 52.57 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.809 1.644 . . . . 0.0 112.453 -178.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.65 174.18 12.67 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.821 2.348 . . . . 0.0 113.609 -178.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -52.09 -35.72 48.68 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.49 1.516 . . . . 0.0 113.094 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -52.9 -41.26 64.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.459 1.503 . . . . 0.0 113.178 172.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 69.7 t -80.75 -41.24 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.488 1.115 . . . . 0.0 111.828 175.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 43.2 t -56.58 -37.82 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.382 0.673 . . . . 0.0 111.299 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.2 tptt -62.12 -50.69 70.88 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.352 -0.842 . . . . 0.0 112.312 172.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.27 -46.8 76.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.523 0.729 . . . . 0.0 111.532 177.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -51.78 -53.8 35.78 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.678 1.191 . . . . 0.0 111.747 168.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.25 -47.45 83.52 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.671 1.123 . . . . 0.0 113.925 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.74 -41.33 96.01 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.155 0.582 . . . . 0.0 111.621 178.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.9 tp -60.16 -44.99 94.58 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.21 0.604 . . . . 0.0 111.42 172.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.636 HD11 HG21 ' A' ' 36' ' ' ILE . 1.5 mm? -61.7 -38.82 89.25 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.513 1.925 . . . . 0.0 114.012 178.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -54.25 -31.1 52.63 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 174.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -68.65 -44.96 73.03 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.193 0.997 . . . . 0.0 112.399 175.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -101.41 26.99 6.62 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.741 2.016 . . . . 0.0 112.606 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -24.95 43.79 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.903 1.281 . . . . 0.0 113.918 -179.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.81 -30.53 64.14 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.297 1.839 . . . . 0.0 113.262 176.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.5 mmtt -65.85 142.86 57.78 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.335 1.054 . . . . 0.0 110.212 176.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.59 158.25 34.38 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.464 0.706 . . . . 0.0 109.465 171.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -37.96 -58.99 1.27 Allowed Pre-proline 0 CA--C 1.552 1.056 0 CA-C-O 117.242 -1.361 . . . . 0.0 113.956 173.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -57.98 -44.25 41.49 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.012 3.141 . . . . 0.0 114.536 177.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -58.97 -39.01 80.42 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.922 0.889 . . . . 0.0 111.755 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.636 HG21 HD11 ' A' ' 25' ' ' LEU . 25.0 mt -66.07 -47.4 85.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 124.026 0.931 . . . . 0.0 110.362 173.069 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -52.26 -39.01 59.83 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.15 -57.35 9.88 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 122.091 0.948 . . . . 0.0 113.164 170.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -32.49 74.0 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.284 -0.885 . . . . 0.0 112.551 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.725 HD13 ' HE1' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -62.31 -49.97 73.51 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.015 1.326 . . . . 0.0 110.77 170.942 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -54.66 -35.53 63.62 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.893 0.877 . . . . 0.0 113.131 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.36 45.04 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.725 ' HE1' HD13 ' A' ' 40' ' ' LEU . 9.7 p-90 -73.79 -33.83 64.39 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 174.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.422 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -57.74 -31.57 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.401 1.48 . . . . 0.0 111.656 174.663 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -57.8 -17.84 18.32 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.383 0.992 . . . . 0.0 112.82 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.68 -11.32 23.64 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.172 1.389 . . . . 0.0 113.223 176.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.567 HD11 ' CH2' ' A' ' 43' ' ' TRP . 30.5 mt -66.25 -71.21 0.2 Allowed 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 119.079 0.854 . . . . 0.0 112.618 171.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 79.3 99.05 0.26 Allowed Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.431 1.015 . . . . 0.0 112.699 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.16 -171.7 40.97 Favored Glycine 0 CA--C 1.533 1.208 0 C-N-CA 124.39 0.995 . . . . 0.0 113.03 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 57.2 m-20 -58.63 -18.29 29.26 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.369 1.468 . . . . 0.0 113.57 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -52.01 -24.33 6.47 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.748 2.019 . . . . 0.0 113.78 170.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.456 ' HA ' ' CD2' ' A' ' 55' ' ' PHE . 9.1 ptmt -44.84 -41.2 6.84 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.475 1.51 . . . . 0.0 113.712 172.14 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.34 -43.19 82.15 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.359 1.064 . . . . 0.0 112.953 177.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.55 -45.04 77.32 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.014 -1.054 . . . . 0.0 110.484 169.148 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.456 ' CD2' ' HA ' ' A' ' 52' ' ' LYS . 3.6 m-30 -60.87 -43.92 97.77 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.46 1.027 . . . . 0.0 112.49 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -60.33 -44.2 95.72 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 118.416 0.553 . . . . 0.0 111.762 177.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.93 -38.19 66.91 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.083 0.553 . . . . 0.0 112.486 -178.641 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -65.78 -48.63 71.15 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.351 1.061 . . . . 0.0 112.7 176.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -43.57 75.27 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.003 0.365 . . . . 0.0 111.255 177.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? -58.28 -54.03 51.57 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.08 1.752 . . . . 0.0 112.967 172.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -53.28 -47.51 69.1 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.222 0.919 . . . . 0.0 112.064 175.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -59.78 -53.41 58.25 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 123.742 0.817 . . . . 0.0 112.451 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.5 mttm -57.36 -34.47 68.84 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.216 1.006 . . . . 0.0 112.195 175.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.01 -51.38 32.77 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.882 0.873 . . . . 0.0 111.747 178.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.34 -52.45 65.3 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.321 1.048 . . . . 0.0 110.388 176.108 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -61.31 -49.84 75.4 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.202 1.001 . . . . 0.0 111.951 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.61 -48.72 78.65 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.511 1.505 . . . . 0.0 112.753 177.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -62.44 -53.96 47.23 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.184 0.594 . . . . 0.0 111.988 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.5 tp -54.09 -51.27 64.68 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.08 1.352 . . . . 0.0 110.354 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.81 -48.19 82.14 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 124.119 0.968 . . . . 0.0 111.393 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.96 -50.59 68.52 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 120.747 1.612 . . . . 0.0 112.315 176.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.0 -50.89 71.97 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.628 0.771 . . . . 0.0 112.666 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -58.76 -48.96 79.41 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.746 1.219 . . . . 0.0 110.932 178.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -54.38 -44.31 72.17 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.606 1.962 . . . . 0.0 112.539 174.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -59.02 -50.54 73.71 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.472 0.709 . . . . 0.0 112.014 175.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.19 -38.16 90.07 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 121.221 0.534 . . . . 0.0 112.286 175.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.8 t -69.02 -27.56 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 C-N-CA 125.84 1.656 . . . . 0.0 112.868 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.18 -22.04 6.0 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 174.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.2 pttt -116.45 1.52 12.99 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.96 1.704 . . . . 0.0 114.566 174.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 31.9 tpp -86.56 -83.86 0.18 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.754 1.621 . . . . 0.0 111.175 -177.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.7 150.72 76.57 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 127.579 2.351 . . . . 0.0 112.452 -175.19 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -71.22 -49.7 0.36 Allowed 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 123.899 3.066 . . . . 0.0 113.372 -176.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.4 -37.97 89.4 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.857 1.263 . . . . 0.0 112.2 177.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.69 -36.06 82.61 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.316 0.646 . . . . 0.0 110.774 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.73 -48.32 66.77 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.087 0.955 . . . . 0.0 111.603 173.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 mttm -63.92 -53.3 52.54 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.238 1.015 . . . . 0.0 111.199 177.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -53.46 -55.49 24.83 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.281 0.632 . . . . 0.0 112.275 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -67.79 -37.67 82.34 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.718 0.807 . . . . 0.0 112.67 -176.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.5 -49.41 77.66 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.398 -0.814 . . . . 0.0 111.076 172.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.21 -41.02 87.61 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.464 1.106 . . . . 0.0 112.526 175.271 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.414 ' HA ' HG22 ' A' ' 94' ' ' ILE . 7.5 mp -66.88 -38.93 87.22 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 119.352 0.978 . . . . 0.0 112.608 172.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.5 t -71.4 -42.63 68.1 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 120.473 -1.392 . . . . 0.0 113.022 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -49.56 68.42 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.324 0.65 . . . . 0.0 109.614 174.114 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.414 HG22 ' HA ' ' A' ' 91' ' ' LEU . 8.8 tp -65.46 -28.14 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -178.185 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.61 -26.87 68.26 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 177.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -104.66 -27.34 11.88 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.379 1.071 . . . . 0.0 113.173 173.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -89.69 82.78 6.26 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.503 1.521 . . . . 0.0 113.134 -178.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -73.38 -24.45 60.31 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 120.351 -1.468 . . . . 0.0 113.967 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.1 t -75.97 -17.87 59.54 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.36 1.064 . . . . 0.0 113.793 -178.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -79.87 164.3 23.68 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.836 1.654 . . . . 0.0 112.166 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 24.5 p30 -71.94 170.8 13.0 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.2 1.0 . . . . 0.0 113.063 174.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -77.83 53.43 3.69 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 125.417 1.484 . . . . 0.0 114.078 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.94 -28.78 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.933 1.293 . . . . 0.0 112.885 -177.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -43.71 -35.8 1.97 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.502 1.521 . . . . 0.0 114.032 170.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -60.95 -59.38 5.46 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.599 0.76 . . . . 0.0 111.536 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.11 -31.54 72.79 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.831 0.741 . . . . 0.0 111.892 -176.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.36 -52.33 65.71 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.451 0.301 . . . . 0.0 111.445 172.223 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -54.67 -46.87 74.1 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 117.91 -1.043 . . . . 0.0 111.646 174.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 27.4 mm -52.97 -49.81 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.355 1.062 . . . . 0.0 111.731 174.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 68.6 mm-40 -64.41 -46.22 84.21 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.064 1.302 . . . . 0.0 112.947 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.39 -48.9 77.84 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.124 0.969 . . . . 0.0 111.725 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.59 -40.09 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.161 173.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -58.79 -37.87 77.29 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.304 1.411 . . . . 0.0 113.439 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 50.8 mttm -63.34 -17.41 62.55 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 173.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 4.8 t -119.93 24.42 10.53 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.356 1.862 . . . . 0.0 113.199 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.69 71.29 2.45 Favored Pre-proline 0 CA--C 1.552 1.033 0 C-N-CA 126.253 1.821 . . . . 0.0 110.643 177.437 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.6 166.93 24.2 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.013 2.475 . . . . 0.0 112.188 174.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -60.89 -24.66 66.15 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 174.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 71.5 m -62.7 -51.61 66.54 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 120.009 1.277 . . . . 0.0 112.044 176.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.6 p -70.22 -38.94 76.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 121.905 -0.497 . . . . 0.0 111.137 176.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.2 tttt -61.21 -45.69 93.52 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.109 0.868 . . . . 0.0 112.071 177.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -69.87 -39.43 76.32 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.057 0.943 . . . . 0.0 113.05 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -67.54 -36.74 81.56 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.199 -0.938 . . . . 0.0 112.412 176.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.23 -19.44 31.64 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.351 1.06 . . . . 0.0 113.26 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -54.59 -26.87 35.18 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.951 1.7 . . . . 0.0 113.833 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.94 -21.06 66.31 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.978 1.711 . . . . 0.0 113.233 172.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 60.76 -134.99 49.48 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.606 1.574 . . . . 0.0 112.822 -177.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -128.92 62.29 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 126.49 1.916 . . . . 0.0 110.777 -171.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 50.85 74.81 0.25 Allowed Glycine 0 CA--C 1.541 1.686 0 C-N-CA 126.462 1.982 . . . . 0.0 113.138 -173.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -71.79 95.94 0.74 Allowed 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 124.38 3.387 . . . . 0.0 111.96 -171.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 57.28 107.47 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 127.116 2.166 . . . . 0.0 113.263 -168.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 7.4 p -107.22 79.3 0.71 Allowed Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.518 1.527 . . . . 0.0 111.689 174.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -72.78 -12.09 26.26 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.321 2.681 . . . . 0.0 114.357 179.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . 0.298 13.8 pt20 . . . . . 0 C--O 1.253 1.268 1 C-N-CA 132.297 4.239 . . . . 0.0 118.194 -179.527 . . . . . . . . 2 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.548 0.892 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.8 -63.19 1.11 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.664 1.186 . . . . 0.0 112.372 178.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.3 158.46 86.72 Favored Pre-proline 0 N--CA 1.471 0.609 0 C-N-CA 124.407 1.083 . . . . 0.0 111.632 174.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -69.81 165.16 31.94 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.589 2.193 . . . . 0.0 111.799 177.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.59 116.46 3.66 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.647 2.898 . . . . 0.0 111.399 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -68.67 -23.06 36.76 Favored 'Trans proline' 0 CA--C 1.551 1.335 0 CA-C-O 115.882 -1.799 . . . . 0.0 115.511 167.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.02 160.47 49.22 Favored 'Trans proline' 0 C--N 1.363 1.314 0 CA-C-N 124.122 2.508 . . . . 0.0 112.537 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -64.87 130.14 25.24 Favored 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 123.54 2.827 . . . . 0.0 111.454 174.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -52.1 -49.78 62.92 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.125 -0.984 . . . . 0.0 112.505 174.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.16 -2.07 17.33 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -15.48 99.12 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.782 2.833 . . . . 0.0 115.192 -175.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 162.61 -21.69 0.19 Allowed Glycine 0 CA--C 1.537 1.413 0 C-N-CA 124.549 1.071 . . . . 0.0 114.98 -177.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.17 161.56 72.63 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 124.54 1.136 . . . . 0.0 113.135 176.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.47 172.67 15.67 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.438 2.758 . . . . 0.0 113.991 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -52.84 -36.34 58.66 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.991 1.316 . . . . 0.0 113.33 -179.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -54.05 -39.91 66.64 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.513 1.525 . . . . 0.0 112.7 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 72.3 t -83.29 -39.87 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.536 1.534 . . . . 0.0 111.754 176.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 59.4 t -55.9 -39.72 58.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.066 0.946 . . . . 0.0 111.022 177.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 tptm -60.57 -50.64 72.74 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.718 0.807 . . . . 0.0 111.935 172.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.78 -47.15 74.32 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.672 0.669 . . . . 0.0 111.945 178.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.52 ' CD1' HD11 ' A' ' 40' ' ' LEU . 10.3 t80 -53.48 -53.47 51.03 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.459 1.104 . . . . 0.0 112.06 168.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.21 -47.42 83.51 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 119.086 0.857 . . . . 0.0 113.136 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.15 -37.65 88.07 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.793 0.837 . . . . 0.0 112.054 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.9 tp -60.57 -52.55 64.67 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.559 0.744 . . . . 0.0 111.193 171.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.562 HD21 HD21 ' A' ' 40' ' ' LEU . 3.8 mm? -71.28 -27.34 63.36 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.019 1.328 . . . . 0.0 113.601 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.5 mmtt -52.48 -48.07 66.15 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.029 1.731 . . . . 0.0 112.687 173.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 tttt -67.08 -24.03 65.92 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 178.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -109.75 30.48 6.64 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.32 2.248 . . . . 0.0 112.46 178.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -54.83 -23.3 17.68 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 119.976 -1.703 . . . . 0.0 113.917 -173.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.7 p -77.08 8.17 4.19 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.715 2.806 . . . . 0.0 114.989 172.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.09 171.95 0.23 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.25 1.82 . . . . 0.0 114.112 170.278 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 m -138.17 170.07 16.68 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 127.773 2.429 . . . . 0.0 109.409 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -40.14 -56.76 3.17 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 127.335 2.254 . . . . 0.0 113.436 175.043 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.64 -36.51 14.36 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 122.51 2.14 . . . . 0.0 113.856 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.93 -40.91 95.76 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.556 1.071 . . . . 0.0 111.064 178.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 22.6 mt -62.57 -53.39 47.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.44 -38.45 91.17 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 119.017 -1.073 . . . . 0.0 111.909 -175.074 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.7 ttmt -65.19 -60.17 3.29 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 125.103 1.361 . . . . 0.0 112.138 177.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -59.41 -38.62 81.07 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.678 0.672 . . . . 0.0 112.197 -179.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.58 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.0 OUTLIER -66.22 -51.15 60.46 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.474 176.4 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -59.01 -33.3 70.56 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.99 -52.17 65.14 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.686 ' CH2' HD11 ' A' ' 47' ' ' LEU . 8.7 p-90 -73.91 -35.02 64.59 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 114.376 1.251 . . . . 0.0 114.376 169.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -57.6 -27.8 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 O-C-N 120.266 -1.521 . . . . 0.0 111.795 176.085 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -56.17 -25.75 47.86 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.775 0.83 . . . . 0.0 112.501 176.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 38.7 p -88.65 -20.97 24.22 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.686 HD11 ' CH2' ' A' ' 43' ' ' TRP . 41.3 mt -64.77 -62.13 1.76 Allowed 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 118.433 0.56 . . . . 0.0 111.909 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 75.85 93.79 0.18 Allowed Glycine 0 CA--C 1.532 1.124 0 C-N-CA 124.728 1.156 . . . . 0.0 112.544 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.71 -165.33 29.58 Favored Glycine 0 CA--C 1.53 0.99 0 C-N-CA 124.792 1.187 . . . . 0.0 112.307 -177.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.7 -13.28 5.55 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.11 1.364 . . . . 0.0 113.907 177.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -52.94 -24.68 9.81 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.527 1.931 . . . . 0.0 113.635 174.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt -53.01 -36.11 60.14 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.389 1.476 . . . . 0.0 114.203 170.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.7 -43.26 80.52 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.099 0.96 . . . . 0.0 111.475 176.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.53 -41.53 90.25 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.688 -0.632 . . . . 0.0 111.419 170.075 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -58.99 -50.28 74.68 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 119.797 1.18 . . . . 0.0 112.365 175.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.65 -45.31 92.38 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 118.106 0.412 . . . . 0.0 111.814 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.3 t -66.97 -43.18 83.71 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -65.51 -54.01 34.23 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.437 0.695 . . . . 0.0 112.114 177.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -49.76 -46.43 50.54 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.907 0.883 . . . . 0.0 111.584 177.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -57.49 -55.71 31.27 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.173 1.389 . . . . 0.0 113.269 172.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -55.01 -44.03 74.19 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 118.89 0.768 . . . . 0.0 112.726 176.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.72 -53.31 56.32 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.525 1.13 . . . . 0.0 112.917 176.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 6.2 mtpp -56.66 -36.17 69.25 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 119.053 -0.499 . . . . 0.0 111.847 174.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.14 -49.9 52.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.814 0.846 . . . . 0.0 111.673 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.9 tttt -58.95 -51.16 71.24 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.412 1.085 . . . . 0.0 110.827 177.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.94 -50.1 74.78 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.682 1.193 . . . . 0.0 112.134 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.52 -49.97 71.18 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.179 0.9 . . . . 0.0 113.118 176.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -63.96 -47.11 81.71 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.465 0.706 . . . . 0.0 112.505 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.6 mt -56.46 -46.79 80.19 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.897 0.879 . . . . 0.0 112.032 173.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.25 -48.43 81.49 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.273 1.029 . . . . 0.0 111.182 177.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -50.87 67.41 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 119.963 1.256 . . . . 0.0 112.039 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.61 -48.92 75.38 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.376 0.67 . . . . 0.0 112.345 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.9 m80 -55.51 -54.09 48.29 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.961 0.904 . . . . 0.0 111.515 173.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -54.52 -41.04 69.21 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.897 1.679 . . . . 0.0 112.673 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -51.3 69.34 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.822 0.849 . . . . 0.0 111.935 174.058 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.07 -29.29 69.03 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 175.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 63.8 t -73.02 -28.44 26.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.65 1.98 . . . . 0.0 112.286 175.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.86 -36.36 58.9 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 174.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -90.98 2.17 56.49 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.642 1.577 . . . . 0.0 113.987 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 3.9 ttm -97.43 -77.02 0.5 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.421 1.488 . . . . 0.0 111.519 -174.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.71 149.56 73.33 Favored Pre-proline 0 N--CA 1.481 1.122 0 C-N-CA 126.285 1.834 . . . . 0.0 112.806 -176.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.24 -46.53 0.66 Allowed 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.768 2.978 . . . . 0.0 113.184 -177.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -68.02 -33.06 73.87 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.565 1.146 . . . . 0.0 112.523 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.59 76.04 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.915 0.486 . . . . 0.0 111.228 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.11 -51.77 65.36 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.857 0.753 . . . . 0.0 110.594 169.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -57.27 -54.7 43.82 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.513 1.125 . . . . 0.0 110.849 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.48 -52.53 65.2 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.22 -34.86 78.98 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.352 0.661 . . . . 0.0 112.432 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.3 -48.12 76.85 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 119.716 1.143 . . . . 0.0 110.774 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.25 -45.68 76.08 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.051 0.941 . . . . 0.0 112.34 171.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 8.3 tp -63.1 -39.14 93.82 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 118.836 0.744 . . . . 0.0 112.67 174.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.0 t -71.92 -41.72 67.54 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 120.603 -1.31 . . . . 0.0 112.238 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.61 -42.49 78.06 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.283 0.633 . . . . 0.0 110.869 176.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.9 tp -70.07 -31.46 47.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 118.46 0.573 . . . . 0.0 112.311 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.09 -31.7 72.17 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -81.59 -12.83 58.61 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 172.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.61 ' HB3' HD13 ' A' ' 100' ' ' LEU . 1.7 m-20 -158.15 95.71 1.39 Allowed 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 119.882 1.219 . . . . 0.0 113.533 -171.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.72 -8.63 57.65 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 58.8 m -80.99 -0.06 37.83 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.638 1.575 . . . . 0.0 114.666 178.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.61 HD13 ' HB3' ' A' ' 97' ' ' ASP . 6.3 mp -69.89 172.44 7.73 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.33 1.452 . . . . 0.0 112.694 175.504 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -69.34 177.68 2.72 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.197 1.399 . . . . 0.0 111.78 173.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.88 55.62 3.05 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.642 1.591 . . . . 0.0 113.881 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.74 -27.46 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 124.654 1.182 . . . . 0.0 112.788 -177.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -47.96 -34.19 8.84 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.508 1.523 . . . . 0.0 113.536 172.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -59.2 5.77 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 118.775 0.716 . . . . 0.0 111.304 173.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.89 79.23 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.538 0.735 . . . . 0.0 112.488 -179.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -53.91 -52.23 61.2 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.421 1.088 . . . . 0.0 110.714 169.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -49.61 75.54 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 117.631 -1.176 . . . . 0.0 111.509 175.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.5 mm -54.21 -49.58 61.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 119.53 1.059 . . . . 0.0 111.501 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 69.5 mm-40 -62.06 -44.74 96.03 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.301 -0.874 . . . . 0.0 112.369 176.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.61 -48.95 78.58 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 119.131 0.878 . . . . 0.0 112.329 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -67.15 -35.76 75.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.514 0.725 . . . . 0.0 111.85 176.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -69.78 -32.61 71.19 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.881 0.872 . . . . 0.0 112.947 175.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.7 mmtm -68.43 -24.17 64.71 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 119.75 -1.844 . . . . 0.0 112.079 175.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.4 t -98.93 44.22 1.03 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.296 1.439 . . . . 0.0 112.78 173.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.41 HD22 HG11 ' A' ' 120' ' ' VAL . 2.4 mt -50.33 145.1 10.74 Favored Pre-proline 0 N--CA 1.478 0.94 0 O-C-N 120.625 -1.297 . . . . 0.0 112.005 172.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -64.81 160.02 42.83 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 122.945 2.43 . . . . 0.0 112.645 -176.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -61.45 -27.6 68.68 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.538 -0.726 . . . . 0.0 112.174 177.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 22.7 t -61.14 -51.69 68.01 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.641 1.109 . . . . 0.0 112.129 177.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.41 HG11 HD22 ' A' ' 116' ' ' LEU . 11.2 p -74.99 -38.76 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.612 -0.68 . . . . 0.0 111.804 178.233 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -56.98 -51.15 70.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.626 171.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -63.95 -43.52 95.57 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.015 1.28 . . . . 0.0 112.699 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -66.51 -34.43 77.89 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.256 0.935 . . . . 0.0 112.804 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.34 -23.88 24.46 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.207 1.003 . . . . 0.0 113.242 178.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -55.76 -24.71 37.01 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 126.472 1.909 . . . . 0.0 113.187 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 8.5 tmtm? -52.71 -39.58 62.17 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 125.145 1.378 . . . . 0.0 111.735 172.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 41.64 -131.85 3.89 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.828 1.68 . . . . 0.0 111.848 -178.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.1 pp -151.16 54.93 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 126.087 1.755 . . . . 0.0 111.397 -176.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 51.17 74.77 0.26 Allowed Glycine 0 CA--C 1.541 1.688 0 C-N-CA 125.998 1.761 . . . . 0.0 113.587 -176.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -70.43 -27.21 23.57 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.41 2.74 . . . . 0.0 114.359 -170.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 41.32 58.27 2.68 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 127.31 2.244 . . . . 0.0 114.314 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 14.6 p -70.91 133.97 85.93 Favored Pre-proline 0 N--CA 1.473 0.721 0 C-N-CA 124.904 1.282 . . . . 0.0 111.156 179.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -73.06 -169.26 0.49 Allowed 'Trans proline' 0 CA--C 1.549 1.232 0 C-N-CA 123.656 2.904 . . . . 0.0 112.597 174.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.239 0 C-N-CA 126.145 1.778 . . . . 0.0 112.664 -177.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 16.2 t70 . . . . . 0 CA--C 1.548 0.885 0 CA-C-O 120.846 0.355 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -157.65 -174.91 5.09 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.382 1.073 . . . . 0.0 112.642 175.159 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 p -56.52 158.44 8.14 Favored Pre-proline 0 N--CA 1.483 1.195 0 C-N-CA 124.319 1.048 . . . . 0.0 113.115 171.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -67.96 162.71 38.67 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 122.558 2.172 . . . . 0.0 112.277 178.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -63.46 117.63 4.58 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.445 2.763 . . . . 0.0 111.437 -179.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -71.6 -21.3 25.82 Favored 'Trans proline' 0 CA--C 1.553 1.433 0 CA-C-O 115.714 -1.869 . . . . 0.0 116.287 167.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.83 165.98 29.22 Favored 'Trans proline' 0 C--N 1.362 1.275 0 CA-C-N 124.36 2.593 . . . . 0.0 112.356 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.432 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 35.2 Cg_endo -58.77 131.5 42.45 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.52 2.146 . . . . 0.0 111.019 169.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -49.89 -49.6 49.01 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.999 0.52 . . . . 0.0 110.734 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.546 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.2 pt? -80.24 28.54 0.3 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.671 1.988 . . . . 0.0 115.081 176.635 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -40.32 107.62 0.07 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.494 1.518 . . . . 0.0 114.297 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.55 17.11 0.3 Allowed Glycine 0 CA--C 1.537 1.466 0 C-N-CA 124.784 1.183 . . . . 0.0 115.044 -174.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.67 158.23 36.15 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.842 1.657 . . . . 0.0 112.132 -173.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -73.0 167.18 28.05 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.778 2.319 . . . . 0.0 112.732 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -53.78 -38.74 64.78 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.61 1.164 . . . . 0.0 113.093 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.96 -40.14 63.48 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.586 1.554 . . . . 0.0 112.825 173.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.9 t -82.75 -39.71 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.029 1.332 . . . . 0.0 111.713 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.8 t -56.03 -40.25 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.863 0.756 . . . . 0.0 110.955 176.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.4 tptt -61.26 -50.52 72.7 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.081 -1.012 . . . . 0.0 111.866 174.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.0 75.01 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.43 0.692 . . . . 0.0 112.025 178.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.432 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 1.5 t80 -52.82 -53.75 44.11 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.728 1.211 . . . . 0.0 112.273 168.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.66 -47.37 85.9 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.646 1.112 . . . . 0.0 113.579 -178.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -61.15 -38.77 87.62 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.849 0.86 . . . . 0.0 111.407 176.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.5 tp -64.15 -47.69 78.92 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 121.819 -0.55 . . . . 0.0 111.465 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.61 -35.52 76.32 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.576 1.55 . . . . 0.0 114.26 -178.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.22 -31.0 61.12 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.348 1.431 . . . . 0.0 113.025 175.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -70.38 -36.43 74.11 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.721 1.608 . . . . 0.0 112.507 176.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -109.81 20.18 18.31 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.438 1.895 . . . . 0.0 112.375 -176.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -26.1 66.6 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.053 -1.654 . . . . 0.0 113.5 -175.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 33.0 p -85.27 -0.32 54.33 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.659 2.384 . . . . 0.0 114.379 177.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -82.69 167.91 17.76 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 125.418 1.487 . . . . 0.0 112.609 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.21 171.52 9.44 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.926 2.09 . . . . 0.0 111.94 178.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -46.04 -61.16 2.73 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 126.746 2.018 . . . . 0.0 112.595 172.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.35 -38.32 20.75 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 121.894 1.729 . . . . 0.0 112.744 177.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -42.07 99.35 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 120.444 -1.41 . . . . 0.0 112.684 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.1 mt -68.18 -53.34 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 124.25 1.02 . . . . 0.0 110.385 173.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -56.9 -37.62 71.67 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.368 0.986 . . . . 0.0 112.468 -174.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -59.47 -56.99 15.07 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.146 1.378 . . . . 0.0 111.919 177.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -65.59 -35.2 80.15 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.688 0.395 . . . . 0.0 111.919 -178.096 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.775 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.8 mm? -61.32 -51.07 70.4 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.053 1.341 . . . . 0.0 112.229 170.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -60.71 -36.94 80.07 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.25 -0.906 . . . . 0.0 112.862 177.17 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.34 -49.16 72.95 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.775 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.2 p-90 -73.7 -35.59 65.15 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 170.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -56.63 -31.59 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 125.393 1.477 . . . . 0.0 112.229 175.2 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -57.6 -19.61 27.16 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 119.027 0.831 . . . . 0.0 112.906 176.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.7 -15.35 23.98 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.119 1.367 . . . . 0.0 113.727 174.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.674 HD11 ' CH2' ' A' ' 43' ' ' TRP . 48.7 mt -67.76 -65.59 0.67 Allowed 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 118.924 0.784 . . . . 0.0 112.453 174.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 76.88 91.27 0.25 Allowed Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.163 0.887 . . . . 0.0 112.621 -178.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -175.39 -164.25 29.63 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.093 1.33 . . . . 0.0 112.348 -176.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -58.05 -15.38 9.07 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.996 1.318 . . . . 0.0 113.738 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -53.07 -25.41 12.66 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.612 2.365 . . . . 0.0 113.984 174.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -52.3 -39.48 60.57 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.968 1.707 . . . . 0.0 113.221 171.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.59 -52.04 59.61 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.229 1.012 . . . . 0.0 110.532 176.217 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.88 -46.03 71.24 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.579 -0.701 . . . . 0.0 111.367 176.6 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -54.76 -49.14 71.59 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 173.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.03 -47.97 79.63 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 119.129 0.877 . . . . 0.0 111.531 179.611 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -48.71 80.59 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.075 1.35 . . . . 0.0 113.298 177.358 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -61.01 -53.02 62.38 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.519 1.128 . . . . 0.0 111.695 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -54.09 -46.45 72.08 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.888 0.875 . . . . 0.0 111.811 177.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.6 mttt -55.82 -53.03 61.64 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.069 0.948 . . . . 0.0 112.361 172.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -55.78 -42.84 76.11 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.887 0.875 . . . . 0.0 112.639 177.007 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -61.61 -53.34 57.52 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.897 0.879 . . . . 0.0 112.869 176.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt -60.67 -32.29 71.5 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 118.997 -0.525 . . . . 0.0 111.82 175.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.34 -51.61 35.3 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.796 0.838 . . . . 0.0 111.15 178.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.8 ttmt -61.06 -48.1 83.29 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.214 0.461 . . . . 0.0 110.593 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.94 -51.82 68.06 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.578 1.151 . . . . 0.0 112.707 177.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.67 -43.75 90.01 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.782 1.174 . . . . 0.0 112.858 177.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -63.22 -50.45 70.19 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.656 0.782 . . . . 0.0 112.022 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.3 mt -57.1 -50.81 71.63 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.113 0.965 . . . . 0.0 111.171 176.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.42 -45.33 84.74 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.991 0.917 . . . . 0.0 112.283 175.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -59.04 -50.78 72.79 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-N 120.766 1.621 . . . . 0.0 111.781 177.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.28 75.81 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -56.63 -52.28 65.46 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.932 0.893 . . . . 0.0 110.699 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.45 -41.61 73.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.973 1.309 . . . . 0.0 113.224 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -57.83 -52.42 65.53 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.931 0.892 . . . . 0.0 112.255 173.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.57 -36.06 82.66 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 176.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 37.3 t -68.59 -27.83 37.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 126.321 1.848 . . . . 0.0 113.166 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.6 -29.29 37.0 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 175.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.6 pttt -105.89 0.43 25.89 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.187 1.795 . . . . 0.0 113.795 176.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 45.8 ttm -93.44 -80.55 0.38 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.127 1.771 . . . . 0.0 111.799 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.91 143.82 49.15 Favored Pre-proline 0 N--CA 1.48 1.041 0 C-N-CA 126.997 2.119 . . . . 0.0 112.655 -175.024 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -68.21 -49.83 0.88 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 123.666 2.91 . . . . 0.0 113.304 -178.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.43 -37.01 86.04 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.241 1.416 . . . . 0.0 113.04 176.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.4 -40.09 95.13 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 118.761 -0.638 . . . . 0.0 110.062 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 12.5 tppt? -55.76 -50.18 71.13 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.478 171.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 50.4 mmtt -54.96 -54.6 40.74 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.266 0.939 . . . . 0.0 110.727 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.38 -47.57 81.5 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -71.0 -38.93 72.67 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.107 0.963 . . . . 0.0 112.285 -177.33 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.25 -47.88 82.4 Favored 'General case' 0 N--CA 1.465 0.297 0 O-C-N 121.052 -1.03 . . . . 0.0 111.409 171.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -56.85 -43.7 81.41 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.757 0.708 . . . . 0.0 112.225 172.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 13.0 tp -62.44 -39.94 94.97 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.722 1.147 . . . . 0.0 113.018 172.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.5 t -70.67 -45.16 65.59 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.857 -1.152 . . . . 0.0 112.81 -177.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -41.93 79.71 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.6 0.76 . . . . 0.0 110.984 175.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.3 tt -70.85 -29.73 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 179.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.49 -34.83 71.34 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -79.42 -28.29 41.75 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.399 1.08 . . . . 0.0 113.479 172.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -130.88 89.49 2.76 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.973 1.709 . . . . 0.0 112.469 -173.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -73.84 -9.14 58.35 Favored 'General case' 0 CA--C 1.549 0.933 0 O-C-N 120.643 -1.286 . . . . 0.0 113.909 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 66.8 m -70.12 -7.04 38.33 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 126.491 1.916 . . . . 0.0 115.233 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.83 166.21 15.93 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.783 1.233 . . . . 0.0 112.58 176.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.34 -178.51 3.5 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.217 1.407 . . . . 0.0 112.796 175.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.98 51.51 0.94 Allowed Glycine 0 N--CA 1.475 1.278 0 C-N-CA 126.382 1.944 . . . . 0.0 114.69 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 2.4 tp -53.05 -32.61 18.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 125.515 1.526 . . . . 0.0 113.32 177.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -46.64 -38.1 9.2 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.484 1.113 . . . . 0.0 113.092 173.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -62.52 -59.15 5.35 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.552 0.741 . . . . 0.0 112.039 171.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.5 -36.13 83.19 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.976 0.91 . . . . 0.0 112.815 -175.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -53.68 -54.65 34.9 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 126.636 1.974 . . . . 0.0 110.866 166.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.0 tttt -52.63 -52.09 57.08 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 117.686 -1.15 . . . . 0.0 110.597 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.9 mm -52.27 -50.96 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 119.44 1.018 . . . . 0.0 111.471 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -64.84 -42.57 94.8 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.1 0.864 . . . . 0.0 112.549 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.52 -36.13 83.22 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.887 1.275 . . . . 0.0 113.044 179.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.7 pp -78.13 -42.56 27.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 119.165 0.893 . . . . 0.0 111.856 170.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.41 ' HA ' HD12 ' A' ' 116' ' ' LEU . 58.6 t80 -55.57 -42.34 74.6 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.84 1.256 . . . . 0.0 113.187 179.149 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.63 -21.05 66.62 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.683 -1.261 . . . . 0.0 112.988 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 11.1 t -109.44 22.17 16.12 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.966 1.707 . . . . 0.0 113.201 -177.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.41 HD12 ' HA ' ' A' ' 113' ' ' TYR . 31.8 mt -112.45 156.22 42.55 Favored Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 125.589 1.555 . . . . 0.0 112.886 178.408 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -71.73 160.93 46.71 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.856 3.037 . . . . 0.0 112.899 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -63.39 -20.49 65.59 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 175.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.2 p -65.42 -51.55 59.52 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.933 1.242 . . . . 0.0 112.21 176.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.2 p -72.56 -39.08 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.649 -0.657 . . . . 0.0 111.424 176.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 29.1 mtmt -57.87 -50.15 74.3 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.034 0.834 . . . . 0.0 111.8 173.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -65.88 -40.76 91.9 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.552 1.069 . . . . 0.0 113.551 177.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.22 -35.35 79.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.575 1.08 . . . . 0.0 112.873 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.46 -23.33 26.03 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.356 1.063 . . . . 0.0 113.418 178.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -54.65 -20.81 8.9 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 126.609 1.964 . . . . 0.0 113.834 177.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.84 -18.94 58.76 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.32 1.448 . . . . 0.0 113.694 170.723 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -105.26 110.37 3.46 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 127.737 2.589 . . . . 0.0 111.657 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -117.16 63.4 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 126.289 1.836 . . . . 0.0 111.134 -174.227 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 52.44 74.86 0.26 Allowed Glycine 0 CA--C 1.538 1.521 0 C-N-CA 125.464 1.507 . . . . 0.0 112.698 -173.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -68.3 130.58 21.5 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.771 2.314 . . . . 0.0 111.428 -176.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 57.29 100.78 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 127.975 2.51 . . . . 0.0 114.512 -175.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 10.0 t -119.2 74.59 14.75 Favored Pre-proline 0 N--CA 1.483 1.203 0 C-N-CA 124.936 1.294 . . . . 0.0 111.222 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -75.81 -5.63 16.62 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 124.335 3.357 . . . . 0.0 114.74 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 128.421 2.688 . . . . 0.0 113.206 179.51 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 24.9 t70 . . . . . 0 CA--C 1.55 0.968 0 CA-C-O 121.752 0.786 . . . . 0.0 112.438 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -114.68 -172.02 2.04 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.273 1.829 . . . . 0.0 112.304 -176.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.7 155.16 4.15 Favored Pre-proline 0 N--CA 1.477 0.881 0 C-N-CA 124.544 1.138 . . . . 0.0 112.772 171.471 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -67.27 165.83 25.45 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 122.945 2.43 . . . . 0.0 111.539 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -64.66 117.79 4.83 Favored 'Trans proline' 0 CA--C 1.547 1.158 0 C-N-CA 122.529 2.153 . . . . 0.0 111.726 176.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.04 -21.43 27.61 Favored 'Trans proline' 0 CA--C 1.555 1.569 0 C-N-CA 122.523 2.149 . . . . 0.0 116.55 166.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.36 170.25 17.73 Favored 'Trans proline' 0 C--N 1.363 1.308 0 CA-C-N 124.18 2.529 . . . . 0.0 112.762 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -62.47 123.64 12.78 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.578 2.186 . . . . 0.0 110.846 173.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -52.87 -38.2 61.32 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 122.163 0.982 . . . . 0.0 111.868 169.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.492 ' HB3' HG21 ' A' ' 44' ' ' VAL . 0.5 OUTLIER -83.82 22.42 1.13 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 128.709 2.804 . . . . 0.0 115.064 175.324 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -41.0 113.22 0.37 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.657 1.583 . . . . 0.0 113.44 175.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.94 23.28 0.19 Allowed Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.207 1.384 . . . . 0.0 114.742 -175.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -125.2 158.85 62.18 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 125.789 1.636 . . . . 0.0 112.347 -172.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.37 170.72 19.69 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.211 2.607 . . . . 0.0 113.106 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -52.45 -38.27 58.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.81 1.244 . . . . 0.0 113.277 -177.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -56.22 -40.2 73.7 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.623 1.569 . . . . 0.0 112.349 176.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 79.7 t -79.46 -39.55 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.963 1.305 . . . . 0.0 111.809 174.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 57.8 t -55.65 -38.94 52.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.0 0.92 . . . . 0.0 111.037 177.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -60.43 -50.63 72.81 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.799 -1.188 . . . . 0.0 112.221 174.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.67 -47.62 79.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.361 1.064 . . . . 0.0 111.616 177.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.63 -51.7 46.45 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.167 0.987 . . . . 0.0 111.671 168.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.54 -47.15 86.88 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 120.183 1.356 . . . . 0.0 113.287 -176.355 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -65.45 -34.18 77.68 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 122.545 0.338 . . . . 0.0 111.692 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.95 -54.63 14.32 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 173.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.6 HD22 HD21 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -57.26 -34.17 68.36 Favored 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 123.871 0.868 . . . . 0.0 112.517 -178.503 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -51.5 -30.54 20.51 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 171.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.8 tttt -74.91 -36.08 62.22 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.778 1.231 . . . . 0.0 113.145 173.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -102.64 15.08 30.32 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.499 1.52 . . . . 0.0 113.052 -177.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -63.36 -19.74 64.91 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.477 -1.39 . . . . 0.0 113.385 -172.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -100.4 1.04 40.99 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 126.947 2.099 . . . . 0.0 113.773 -178.627 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -79.38 177.73 8.63 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.786 1.635 . . . . 0.0 111.819 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.93 172.1 8.36 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.864 2.066 . . . . 0.0 111.938 177.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -49.56 -59.24 7.05 Favored Pre-proline 0 CA--C 1.546 0.793 0 C-N-CA 124.721 1.208 . . . . 0.0 113.107 175.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.21 -36.93 15.3 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.868 1.712 . . . . 0.0 112.607 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.74 -49.41 77.6 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.896 -1.127 . . . . 0.0 112.182 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.0 mt -61.94 -53.42 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-O 117.928 -1.034 . . . . 0.0 109.289 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -51.83 -44.87 63.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.301 1.41 . . . . 0.0 111.677 -176.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -51.13 68.34 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 125.108 1.363 . . . . 0.0 112.994 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.62 -39.14 92.87 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.106 0.562 . . . . 0.0 112.479 176.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.72 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.4 mm? -61.68 -50.18 73.52 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.518 1.127 . . . . 0.0 109.848 173.284 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.567 ' HA ' HG12 ' A' ' 44' ' ' VAL . 3.8 m-20 -62.74 -28.38 69.93 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 178.24 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.34 -54.8 39.09 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.465 -0.772 . . . . 0.0 112.667 174.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.72 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.3 p-90 -73.84 -30.42 62.66 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 175.612 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.804 HG23 HD12 ' A' ' 47' ' ' LEU . 0.3 OUTLIER -67.35 -29.67 46.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 120.623 -1.298 . . . . 0.0 112.667 175.567 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -58.95 -15.55 13.48 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.012 0.824 . . . . 0.0 113.147 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.9 p -115.07 -2.99 12.64 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.363 1.465 . . . . 0.0 113.56 177.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.804 HD12 HG23 ' A' ' 44' ' ' VAL . 9.7 mt -62.05 -53.44 55.45 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 175.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -166.59 -146.81 4.99 Favored Glycine 0 C--N 1.336 0.56 0 C-N-CA 123.957 0.789 . . . . 0.0 112.41 -166.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -98.03 -65.68 0.88 Allowed Glycine 0 C--O 1.223 -0.588 0 C-N-CA 124.683 1.135 . . . . 0.0 112.992 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -59.43 -31.68 69.5 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.622 1.169 . . . . 0.0 112.848 -168.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.624 ' HB3' HG22 ' A' ' 44' ' ' VAL . 65.1 m-85 -55.39 -23.44 24.65 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 126.666 1.986 . . . . 0.0 113.649 174.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.2 ptmt -52.95 -33.89 53.08 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 171.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.79 -35.73 79.17 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.479 1.112 . . . . 0.0 111.574 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -43.33 92.22 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 117.961 -1.018 . . . . 0.0 110.831 168.573 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -64.33 -48.3 76.12 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 120.041 1.291 . . . . 0.0 112.512 177.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -58.64 -40.73 84.23 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.671 -0.643 . . . . 0.0 111.545 179.367 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.21 -34.54 59.25 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.99 -51.0 67.59 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.674 1.19 . . . . 0.0 110.737 170.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.5 ttpp -54.38 -45.27 72.8 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 117.987 0.358 . . . . 0.0 111.042 -175.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -61.7 -55.92 25.18 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.988 1.715 . . . . 0.0 113.016 172.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -57.22 -48.61 78.35 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.445 1.021 . . . . 0.0 112.575 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.0 ttt -64.01 -51.28 64.95 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.631 0.772 . . . . 0.0 112.424 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -52.93 -40.04 63.31 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 122.972 0.509 . . . . 0.0 111.86 172.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.14 -48.84 64.27 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.336 0.655 . . . . 0.0 111.244 -178.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -60.13 -53.08 62.03 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.046 0.938 . . . . 0.0 110.389 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -60.12 -50.46 73.6 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.569 1.147 . . . . 0.0 112.437 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.68 -47.33 86.08 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.261 0.937 . . . . 0.0 112.176 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.31 -45.12 85.64 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.252 -0.905 . . . . 0.0 112.823 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.4 mp -56.18 -47.64 77.9 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.735 0.814 . . . . 0.0 110.535 171.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.49 -47.18 84.93 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 117.678 -1.153 . . . . 0.0 111.933 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -56.18 -50.31 71.56 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 121.609 2.004 . . . . 0.0 113.376 175.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.07 -50.35 70.94 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.796 -0.565 . . . . 0.0 112.239 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 34.2 m170 -55.97 -41.13 74.28 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-O 117.694 -1.146 . . . . 0.0 111.354 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -51.03 71.71 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 126.182 1.793 . . . . 0.0 112.398 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -58.99 -47.16 86.15 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.3 176.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.1 -51.04 63.71 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 176.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 41.5 t -59.42 -28.56 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 126.976 2.11 . . . . 0.0 112.586 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.93 -28.57 24.12 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 173.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -101.73 -0.51 34.31 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.028 1.331 . . . . 0.0 114.354 176.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.1 mmt -88.23 -85.73 0.18 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.594 1.158 . . . . 0.0 110.775 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -129.7 155.22 80.71 Favored Pre-proline 0 N--CA 1.476 0.853 0 C-N-CA 127.039 2.135 . . . . 0.0 112.945 -176.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.5 -51.79 0.31 Allowed 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.76 2.973 . . . . 0.0 112.846 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -62.85 -34.18 76.82 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.463 1.505 . . . . 0.0 113.217 177.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -42.61 99.75 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 118.938 -0.553 . . . . 0.0 110.437 178.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.53 -45.85 77.11 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 117.909 -1.043 . . . . 0.0 110.951 171.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.4 mttt -58.08 -54.76 43.35 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.122 1.328 . . . . 0.0 111.839 177.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.62 -54.98 40.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.452 0.701 . . . . 0.0 112.498 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.68 -46.88 77.53 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.331 1.052 . . . . 0.0 112.758 175.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.84 -43.33 99.06 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.55 1.068 . . . . 0.0 111.502 -179.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.18 -46.91 82.42 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.082 0.953 . . . . 0.0 111.881 170.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.434 ' HA ' HG22 ' A' ' 94' ' ' ILE . 6.9 mp -63.53 -32.51 73.99 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 173.52 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.3 t -73.25 -41.45 63.67 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.783 1.233 . . . . 0.0 112.571 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -71.36 -44.36 65.17 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.485 -0.759 . . . . 0.0 111.023 176.052 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.434 HG22 ' HA ' ' A' ' 91' ' ' LEU . 15.8 tt -69.53 -30.07 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 178.59 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.06 -41.78 68.53 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.134 0.879 . . . . 0.0 112.388 176.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -76.03 -27.94 57.51 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.858 1.263 . . . . 0.0 113.518 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -131.52 78.05 1.81 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.835 1.254 . . . . 0.0 111.583 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -69.67 -22.66 63.42 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.622 -1.299 . . . . 0.0 112.916 -177.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 19.4 m -62.44 -15.65 50.69 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.422 1.489 . . . . 0.0 114.339 170.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -109.03 84.06 1.86 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.823 1.249 . . . . 0.0 109.466 176.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -95.01 -174.92 3.38 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.523 1.529 . . . . 0.0 111.546 173.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 109.0 -36.98 4.03 Favored Glycine 0 N--CA 1.47 0.949 0 C-N-CA 125.238 1.399 . . . . 0.0 113.282 177.092 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.457 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -60.93 -27.42 41.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 CA-C-N 118.167 0.984 . . . . 0.0 111.836 174.632 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.44 -37.68 39.39 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.417 1.087 . . . . 0.0 112.94 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.5 mtmt -60.32 -59.41 5.45 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.599 0.76 . . . . 0.0 111.135 173.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.457 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -62.88 -36.17 82.43 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.72 0.808 . . . . 0.0 112.916 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.7 -53.23 57.58 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.42 1.088 . . . . 0.0 110.802 170.527 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 50.6 tttt -55.04 -50.69 68.44 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.654 0.782 . . . . 0.0 111.66 175.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 23.5 mm -51.6 -48.75 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.688 1.195 . . . . 0.0 111.059 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -64.87 -42.58 94.73 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 120.17 1.35 . . . . 0.0 113.025 177.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.94 -40.96 99.22 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.856 0.863 . . . . 0.0 112.979 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -75.88 -35.39 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 121.378 -0.827 . . . . 0.0 111.782 172.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -58.98 -43.44 91.43 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.619 1.168 . . . . 0.0 112.889 179.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.05 -23.13 67.1 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.381 -0.824 . . . . 0.0 112.331 177.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.6 m -99.19 10.51 41.29 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.745 2.018 . . . . 0.0 112.522 -176.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 39.9 mt -65.15 157.12 78.51 Favored Pre-proline 0 CA--C 1.546 0.815 0 O-C-N 120.431 -1.418 . . . . 0.0 113.126 177.081 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -68.46 166.45 25.6 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 123.171 2.581 . . . . 0.0 112.586 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -26.28 53.92 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 174.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.2 t -59.4 -51.65 68.98 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.629 1.104 . . . . 0.0 111.924 179.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.8 -49.19 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.706 -0.621 . . . . 0.0 109.759 173.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -58.42 -37.52 75.54 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.59 -171.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -67.85 -46.28 72.2 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.78 1.632 . . . . 0.0 113.675 170.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -59.43 -34.08 72.04 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.85 1.204 . . . . 0.0 112.959 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.4 pp -91.87 -20.86 21.0 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.784 1.234 . . . . 0.0 113.651 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.33 -38.74 71.75 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.745 1.157 . . . . 0.0 112.412 171.323 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.02 -15.89 35.15 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.682 1.193 . . . . 0.0 113.831 174.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -94.58 106.07 3.36 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 126.067 1.794 . . . . 0.0 113.635 -174.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -140.26 56.82 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 126.094 1.758 . . . . 0.0 112.616 -169.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 49.54 74.97 0.22 Allowed Glycine 0 CA--C 1.539 1.591 0 C-N-CA 125.44 1.495 . . . . 0.0 112.737 -174.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -70.11 172.26 13.3 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.57 2.847 . . . . 0.0 111.914 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 57.92 97.13 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.379 1.871 . . . . 0.0 112.762 -170.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 7.5 p -106.28 80.4 0.68 Allowed Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.928 1.691 . . . . 0.0 111.647 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.68 -1.95 11.8 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.716 2.944 . . . . 0.0 114.278 177.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--O 1.255 1.342 0 C-N-CA 126.782 2.033 . . . . 0.0 112.461 -176.387 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 . . . . . 0 CA--C 1.546 0.812 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -148.83 -74.92 0.17 Allowed 'General case' 0 N--CA 1.475 0.792 0 O-C-N 121.012 -1.055 . . . . 0.0 112.609 176.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -80.56 162.86 59.19 Favored Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 126.581 1.952 . . . . 0.0 113.465 179.48 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -69.98 166.65 27.16 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.272 2.648 . . . . 0.0 112.377 175.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -64.47 116.84 4.0 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 123.762 2.975 . . . . 0.0 111.688 176.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -71.81 -22.09 24.06 Favored 'Trans proline' 0 CA--C 1.553 1.455 0 C-N-CA 122.102 1.868 . . . . 0.0 116.469 167.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.88 166.45 27.7 Favored 'Trans proline' 0 C--N 1.363 1.326 0 CA-C-N 124.332 2.583 . . . . 0.0 112.276 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.422 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 40.2 Cg_endo -58.82 129.39 31.95 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.706 2.27 . . . . 0.0 110.843 171.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -48.68 -48.59 39.89 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 122.826 0.45 . . . . 0.0 111.296 172.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.583 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.9 pt? -83.33 29.29 0.5 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.508 1.923 . . . . 0.0 114.419 178.365 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -37.6 104.19 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.035 1.734 . . . . 0.0 114.919 -179.105 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 147.55 11.0 0.18 Allowed Glycine 0 CA--C 1.542 1.741 0 C-N-CA 125.626 1.584 . . . . 0.0 115.683 -173.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -109.54 159.26 32.18 Favored Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 125.745 1.618 . . . . 0.0 112.612 -172.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -73.98 169.55 22.14 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 123.019 2.479 . . . . 0.0 113.32 179.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -54.62 -38.09 66.39 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.656 1.183 . . . . 0.0 113.267 -177.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -53.39 -39.98 64.69 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.74 1.616 . . . . 0.0 112.486 174.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.2 t -82.08 -38.96 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 124.863 1.265 . . . . 0.0 112.077 176.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.7 t -56.71 -38.77 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 119.02 0.827 . . . . 0.0 111.337 176.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -62.65 -50.38 71.44 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.366 -0.834 . . . . 0.0 112.549 174.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.39 -47.76 75.35 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.083 0.953 . . . . 0.0 111.704 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.422 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 15.5 t80 -51.18 -52.96 39.27 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.265 1.026 . . . . 0.0 111.897 168.493 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -47.4 85.72 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.02 0.827 . . . . 0.0 113.124 -177.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -65.18 -37.84 88.62 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.229 0.612 . . . . 0.0 111.772 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.2 tp -59.27 -52.24 66.49 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.063 0.545 . . . . 0.0 110.884 169.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.62 -29.11 70.37 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -179.246 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.9 mttm -54.15 -35.56 62.37 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.349 1.431 . . . . 0.0 112.9 172.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.57 -32.8 60.52 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.29 1.036 . . . . 0.0 113.118 175.374 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -97.69 16.65 19.95 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.166 1.786 . . . . 0.0 113.367 179.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.6 -17.05 64.3 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 119.787 -1.82 . . . . 0.0 113.867 -170.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.7 p -100.82 1.58 40.26 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 128.051 2.54 . . . . 0.0 113.771 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -79.72 165.48 22.78 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.921 1.688 . . . . 0.0 112.592 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.89 171.02 9.89 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.962 1.705 . . . . 0.0 111.97 176.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -47.91 -59.76 5.3 Favored Pre-proline 0 N--CA 1.474 0.732 0 C-N-CA 126.343 1.857 . . . . 0.0 113.078 174.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -65.16 -30.61 55.26 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 122.118 1.879 . . . . 0.0 113.43 179.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.44 -44.95 63.89 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.639 1.175 . . . . 0.0 111.963 -178.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 80.0 mt -66.57 -53.04 39.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.702 0.801 . . . . 0.0 109.647 172.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.95 -36.49 72.61 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 118.774 0.715 . . . . 0.0 111.837 -174.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -61.41 -60.44 3.71 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 125.382 1.473 . . . . 0.0 113.687 175.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -35.62 75.74 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.823 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.8 mm? -63.79 -51.0 66.77 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.501 1.121 . . . . 0.0 112.194 172.504 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -57.48 -36.71 71.84 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.022 0.828 . . . . 0.0 113.141 175.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.32 -51.1 67.81 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -178.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.823 ' HE1' HD13 ' A' ' 40' ' ' LEU . 6.9 p-90 -73.92 -32.51 63.57 Favored 'General case' 0 CA--C 1.553 1.093 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 170.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.72 -31.16 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 O-C-N 120.584 -1.323 . . . . 0.0 112.017 173.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -55.95 -24.14 36.34 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.065 0.848 . . . . 0.0 112.384 177.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.59 -16.99 26.27 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.031 1.333 . . . . 0.0 113.28 177.288 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.703 HD11 ' CH2' ' A' ' 43' ' ' TRP . 62.8 mt -67.75 -66.83 0.51 Allowed 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 118.669 0.668 . . . . 0.0 112.485 174.559 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 78.77 95.19 0.28 Allowed Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.26 0.933 . . . . 0.0 112.659 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -174.32 -166.49 32.45 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 124.99 1.281 . . . . 0.0 112.232 -178.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -58.06 -12.52 3.47 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.29 1.436 . . . . 0.0 114.333 176.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -53.91 -23.5 13.02 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.944 2.098 . . . . 0.0 113.688 172.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt -52.61 -37.49 58.37 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.209 1.403 . . . . 0.0 113.675 169.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.24 81.04 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.083 0.953 . . . . 0.0 111.599 177.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -67.46 -43.44 81.06 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-O 118.689 -0.672 . . . . 0.0 111.334 172.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -57.28 -53.83 53.66 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 119.873 1.215 . . . . 0.0 112.497 172.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -58.85 -45.3 90.4 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.454 0.57 . . . . 0.0 112.041 -178.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -66.15 -42.22 89.34 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.171 0.588 . . . . 0.0 112.43 178.552 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -66.3 -53.51 35.72 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 118.742 0.701 . . . . 0.0 111.994 178.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.41 -40.37 68.2 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.328 0.651 . . . . 0.0 111.689 178.196 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.4 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 0.7 OUTLIER -60.88 -54.88 39.68 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.354 1.061 . . . . 0.0 113.29 170.292 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -56.76 -50.93 70.79 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.345 0.975 . . . . 0.0 112.746 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 ppp? -60.41 -51.76 68.09 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 176.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -56.39 -35.93 68.3 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.181 0.592 . . . . 0.0 112.478 175.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.01 -51.49 46.53 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.52 0.728 . . . . 0.0 111.155 178.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.4 tttt -60.39 -49.68 76.6 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.52 0.728 . . . . 0.0 111.001 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -61.59 -51.25 69.3 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.272 1.429 . . . . 0.0 112.506 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.94 -44.18 91.36 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.634 1.106 . . . . 0.0 112.525 176.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.81 -51.14 69.48 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.832 0.853 . . . . 0.0 111.792 177.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.6 mt -54.62 -51.16 66.23 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.261 1.024 . . . . 0.0 111.104 174.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.12 -44.38 87.72 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.214 1.006 . . . . 0.0 112.66 178.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.1 tttm -58.33 -50.66 72.85 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.81 1.244 . . . . 0.0 112.0 176.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.62 -46.42 88.35 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.644 0.778 . . . . 0.0 112.221 178.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.99 -51.33 70.1 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.817 0.847 . . . . 0.0 110.831 176.273 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -54.52 -46.49 73.53 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.979 1.312 . . . . 0.0 112.815 174.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -55.65 -50.1 71.13 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.669 0.788 . . . . 0.0 112.525 175.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -68.32 -30.86 69.94 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 176.211 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 63.3 t -72.93 -24.83 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 126.376 1.87 . . . . 0.0 113.42 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.67 -30.3 65.33 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 178.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.2 pttt -86.82 1.08 53.55 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.331 1.453 . . . . 0.0 114.492 173.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.6 ttm -103.88 -159.02 0.7 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.839 2.056 . . . . 0.0 111.568 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.47 156.63 21.75 Favored Pre-proline 0 N--CA 1.479 1.019 0 C-N-CA 125.424 1.49 . . . . 0.0 113.97 177.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.43 -46.6 1.29 Allowed 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 123.843 3.029 . . . . 0.0 113.141 -176.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -61.66 -32.12 72.27 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.784 1.233 . . . . 0.0 112.924 176.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.23 -46.98 86.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 122.751 0.42 . . . . 0.0 110.445 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -55.24 -43.55 74.68 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 118.367 -0.825 . . . . 0.0 111.103 174.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? -58.47 -53.17 61.33 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.681 1.128 . . . . 0.0 112.142 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.52 -44.71 95.75 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -73.13 -39.75 65.47 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.38 -47.66 84.82 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.835 0.854 . . . . 0.0 110.532 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -51.3 -51.66 52.24 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.057 0.943 . . . . 0.0 110.941 170.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -37.37 86.07 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.543 0.611 . . . . 0.0 112.446 -179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.7 t -73.27 -43.59 60.77 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.199 -0.938 . . . . 0.0 112.885 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -46.52 73.72 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.367 0.667 . . . . 0.0 110.525 175.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.7 tp -66.65 -33.53 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 118.852 0.751 . . . . 0.0 112.018 -179.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.92 -31.81 72.96 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 177.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -93.18 -28.25 16.4 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 176.165 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -139.62 84.05 1.96 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.619 1.568 . . . . 0.0 112.523 -166.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -64.57 -9.95 22.83 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -177.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t -105.11 -5.81 20.47 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.682 1.993 . . . . 0.0 114.136 -177.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.3 mp -96.0 84.35 3.82 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.969 1.308 . . . . 0.0 110.473 -179.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -90.58 -169.81 2.51 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.291 1.437 . . . . 0.0 111.834 174.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 97.63 4.82 57.97 Favored Glycine 0 N--CA 1.477 1.39 0 C-N-CA 124.954 1.264 . . . . 0.0 115.418 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.458 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.4 OUTLIER -61.94 -25.95 38.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 118.816 1.308 . . . . 0.0 113.01 -179.871 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -53.61 -35.07 60.49 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.553 -0.717 . . . . 0.0 112.499 -179.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -56.91 -59.52 4.93 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.006 0.522 . . . . 0.0 111.254 171.072 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.458 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -65.38 -38.07 88.93 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.313 0.506 . . . . 0.0 112.066 -175.13 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.03 -51.4 57.7 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.951 1.3 . . . . 0.0 110.459 170.458 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -57.76 -48.52 79.41 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 118.348 -0.834 . . . . 0.0 112.108 175.447 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 35.2 mm -52.72 -52.03 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.686 1.194 . . . . 0.0 111.879 177.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 38.5 mm-40 -66.61 -38.67 87.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.145 1.338 . . . . 0.0 112.547 177.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.85 -37.24 81.42 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.574 0.75 . . . . 0.0 112.976 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -84.53 -30.05 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.3 1.04 . . . . 0.0 113.338 172.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -64.32 -40.11 95.24 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.447 1.099 . . . . 0.0 112.788 177.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.4 pttt -64.98 -23.54 67.25 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.482 -0.761 . . . . 0.0 112.203 176.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 39.9 p -101.32 25.55 8.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 126.876 2.071 . . . . 0.0 113.023 175.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.71 72.05 1.0 Allowed Pre-proline 0 CA--C 1.554 1.112 0 C-N-CA 125.637 1.575 . . . . 0.0 110.448 174.352 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.6 163.7 37.16 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 123.227 2.618 . . . . 0.0 112.157 176.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -58.76 -25.91 63.5 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 174.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.9 m -62.43 -51.63 66.78 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.865 1.211 . . . . 0.0 111.857 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 10.2 p -70.53 -39.91 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 121.931 -0.48 . . . . 0.0 111.406 175.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -59.19 -47.24 86.05 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.381 0.672 . . . . 0.0 111.243 178.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -68.78 -44.65 73.22 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.244 1.017 . . . . 0.0 112.642 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -63.94 -33.83 76.61 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.893 -1.13 . . . . 0.0 113.076 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.0 -24.06 23.64 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.958 0.903 . . . . 0.0 113.037 177.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -52.16 -27.84 15.89 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 126.189 1.795 . . . . 0.0 113.554 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt -54.32 -37.8 65.25 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.686 1.594 . . . . 0.0 113.865 171.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 43.23 73.22 0.25 Allowed Glycine 0 CA--C 1.54 1.603 0 C-N-CA 126.913 2.197 . . . . 0.0 115.755 175.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -114.0 61.7 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.833 1.653 . . . . 0.0 112.842 -170.078 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 52.57 74.9 0.25 Allowed Glycine 0 CA--C 1.541 1.692 0 C-N-CA 125.414 1.483 . . . . 0.0 113.121 -177.081 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -72.05 89.68 0.77 Allowed 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 124.366 3.377 . . . . 0.0 112.938 -171.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -164.24 129.62 2.86 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 128.014 2.526 . . . . 0.0 109.159 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 12.9 t -119.0 75.98 14.42 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 125.356 1.462 . . . . 0.0 109.822 171.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -74.25 177.44 8.28 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 123.755 2.97 . . . . 0.0 112.385 176.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 . . . . . 0 C--O 1.252 1.211 0 C-N-CA 125.985 1.714 . . . . 0.0 111.343 173.749 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 121.355 0.598 . . . . 0.0 112.548 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -124.89 7.04 8.03 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.809 1.644 . . . . 0.0 113.144 -177.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.8 p -101.08 160.82 25.58 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 125.851 1.66 . . . . 0.0 113.2 179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -67.11 165.75 25.41 Favored 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 123.796 2.997 . . . . 0.0 113.201 175.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.19 126.5 15.16 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.897 2.398 . . . . 0.0 110.989 175.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.53 -23.21 37.45 Favored 'Trans proline' 0 CA--C 1.553 1.458 0 C-N-CA 122.765 2.31 . . . . 0.0 116.768 168.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.14 167.19 24.35 Favored 'Trans proline' 0 C--N 1.361 1.227 0 CA-C-N 124.141 2.515 . . . . 0.0 113.125 175.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.418 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 40.1 Cg_endo -61.4 120.83 8.69 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.117 2.545 . . . . 0.0 111.477 172.639 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -51.25 -33.76 29.53 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.088 0.955 . . . . 0.0 111.669 171.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.455 ' CD2' HD12 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -101.3 34.09 2.68 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 127.04 2.136 . . . . 0.0 113.702 178.229 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.49 110.67 0.24 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.016 1.326 . . . . 0.0 113.37 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 145.52 11.03 0.26 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.504 1.526 . . . . 0.0 115.24 -173.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.45 158.19 40.63 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.964 1.706 . . . . 0.0 112.575 -171.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.83 170.19 20.62 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 123.228 2.619 . . . . 0.0 112.962 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -54.82 -37.92 66.73 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.494 1.117 . . . . 0.0 113.545 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.45 -39.75 64.7 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.321 1.448 . . . . 0.0 112.512 173.386 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.5 t -80.69 -41.79 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 124.554 1.142 . . . . 0.0 112.095 175.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.1 t -55.79 -38.97 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 118.922 0.783 . . . . 0.0 111.249 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -60.62 -50.68 72.56 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.181 -0.95 . . . . 0.0 112.266 173.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.35 -47.13 76.2 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.208 1.003 . . . . 0.0 111.529 177.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.418 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -51.79 -53.79 35.95 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.677 1.191 . . . . 0.0 111.995 169.542 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -59.07 -47.51 84.99 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.681 1.128 . . . . 0.0 113.517 -178.76 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -68.09 -30.23 69.35 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.421 0.689 . . . . 0.0 112.298 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.7 tp -69.06 -45.36 70.57 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 121.556 -0.715 . . . . 0.0 111.646 168.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.16 -45.31 95.17 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.255 1.422 . . . . 0.0 113.943 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -24.52 54.59 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 119.36 0.982 . . . . 0.0 113.547 177.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -75.61 -36.48 60.25 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.535 1.934 . . . . 0.0 112.632 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -109.79 20.47 18.02 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.484 1.914 . . . . 0.0 112.798 178.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.9 -24.53 66.06 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.028 -1.67 . . . . 0.0 112.922 -174.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.67 -1.23 30.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.069 2.148 . . . . 0.0 113.797 178.357 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -89.75 171.7 9.45 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.745 1.618 . . . . 0.0 112.13 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.56 170.33 11.98 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 126.267 1.827 . . . . 0.0 112.041 175.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -45.45 -62.34 1.8 Allowed Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.501 1.52 . . . . 0.0 112.969 172.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.35 -35.26 24.43 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.034 1.823 . . . . 0.0 114.022 -179.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -60.57 -44.96 95.59 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.116 -0.99 . . . . 0.0 112.234 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 61.6 mt -70.95 -47.75 60.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 118.74 -0.648 . . . . 0.0 111.162 175.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -52.38 -38.75 59.67 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.023 0.829 . . . . 0.0 110.902 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -51.0 71.21 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.671 1.588 . . . . 0.0 112.394 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.64 -38.49 89.51 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.162 0.585 . . . . 0.0 111.901 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.675 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.1 mm? -62.91 -51.09 68.29 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.459 1.103 . . . . 0.0 110.988 173.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -59.75 -34.0 72.39 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.283 1.033 . . . . 0.0 113.621 176.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.3 -52.24 66.42 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.717 -0.614 . . . . 0.0 112.57 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.683 ' CH2' HD11 ' A' ' 47' ' ' LEU . 10.7 p-90 -73.74 -29.85 62.47 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 172.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.409 HG23 HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -60.64 -32.18 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 O-C-N 120.789 -1.194 . . . . 0.0 112.65 174.205 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -58.1 -17.82 20.76 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 175.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.57 -11.89 18.9 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.801 1.24 . . . . 0.0 113.385 177.59 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.683 HD11 ' CH2' ' A' ' 43' ' ' TRP . 19.9 mt -66.61 -60.84 2.35 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 175.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.78 70.64 1.15 Allowed Glycine 0 CA--C 1.538 1.48 0 C-N-CA 124.39 0.995 . . . . 0.0 113.827 -177.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -159.15 55.27 0.35 Allowed Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.119 1.342 . . . . 0.0 113.514 -178.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 74.18 -6.25 1.89 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 128.731 2.812 . . . . 0.0 114.225 -177.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -63.31 -20.93 65.92 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.863 1.665 . . . . 0.0 114.582 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -54.89 -35.55 64.21 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.969 1.708 . . . . 0.0 113.515 173.035 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.1 -39.04 92.58 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.64 0.776 . . . . 0.0 111.731 174.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.68 -41.49 98.16 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 118.156 -0.925 . . . . 0.0 112.063 170.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -55.24 -53.15 59.74 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.918 1.235 . . . . 0.0 112.506 173.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -61.75 -44.88 96.04 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.979 -0.45 . . . . 0.0 112.194 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.95 -38.74 83.17 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.783 -0.573 . . . . 0.0 112.311 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -65.98 -53.8 34.31 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 123.09 0.556 . . . . 0.0 111.524 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 19.9 ttpt -54.05 -40.86 67.49 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 119.197 -0.43 . . . . 0.0 111.717 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 67.6 mttt -59.0 -57.13 14.44 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.868 1.267 . . . . 0.0 113.911 169.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -53.68 -47.03 70.83 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.114 0.966 . . . . 0.0 112.254 179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -61.93 -53.27 58.06 Favored 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 123.737 0.815 . . . . 0.0 112.258 176.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -55.13 -36.15 65.45 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.122 0.569 . . . . 0.0 111.894 176.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.81 -51.51 40.02 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.008 0.923 . . . . 0.0 111.509 179.081 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.7 mttm -59.27 -49.39 78.01 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.338 1.055 . . . . 0.0 111.591 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.35 -54.11 50.54 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.259 1.423 . . . . 0.0 112.096 177.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.3 -44.63 96.9 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.572 1.078 . . . . 0.0 112.841 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -67.66 -45.45 75.25 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.616 -0.678 . . . . 0.0 112.389 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.49 -51.14 67.97 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.002 0.921 . . . . 0.0 110.565 170.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.02 -43.91 91.66 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.293 0.637 . . . . 0.0 112.247 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -56.74 -50.73 71.36 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.795 1.18 . . . . 0.0 112.161 174.037 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.12 -47.55 82.31 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.14 0.576 . . . . 0.0 112.194 179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.465 ' O ' HG23 ' A' ' 77' ' ' VAL . 1.1 t-80 -56.79 -49.93 73.85 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.919 1.288 . . . . 0.0 110.744 174.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -52.67 -48.6 66.41 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.92 1.688 . . . . 0.0 111.51 177.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -56.93 -49.5 75.45 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.895 1.278 . . . . 0.0 112.654 176.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.79 -30.84 71.54 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.923 1.082 . . . . 0.0 113.923 172.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 73' ' ' HIS . 96.4 t -72.99 -24.43 20.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.967 1.307 . . . . 0.0 112.675 176.223 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.416 ' HB2' ' HE2' ' A' ' 85' ' ' LYS . . . -56.89 -28.73 62.24 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 176.454 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -89.82 1.41 56.19 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.156 1.382 . . . . 0.0 114.573 173.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.4 ttm -105.35 -161.62 0.82 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.795 2.038 . . . . 0.0 111.643 -172.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.9 155.66 22.43 Favored Pre-proline 0 N--CA 1.479 1.01 0 C-N-CA 124.622 1.169 . . . . 0.0 113.536 177.128 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.46 -42.6 3.56 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 123.387 2.725 . . . . 0.0 112.42 -178.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -63.55 -34.71 78.39 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.308 -0.87 . . . . 0.0 112.645 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.4 -41.28 93.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.744 0.818 . . . . 0.0 110.198 175.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.416 ' HE2' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -55.34 -48.05 74.78 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.89 174.907 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -59.4 -52.45 65.57 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.205 1.002 . . . . 0.0 111.629 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.9 -48.69 80.68 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 177.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -70.56 -42.4 71.19 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.447 -0.783 . . . . 0.0 112.512 -176.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.92 -43.4 98.92 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.083 -1.011 . . . . 0.0 112.2 173.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -54.92 -50.09 69.66 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.481 1.112 . . . . 0.0 111.471 171.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.4 tp -59.7 -37.74 79.69 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 173.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.6 t -73.23 -40.27 64.81 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.59 -1.319 . . . . 0.0 112.923 -177.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.5 ptpm? -69.21 -43.41 74.16 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.847 -0.597 . . . . 0.0 110.779 175.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.4 tt -70.03 -33.18 54.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 119.141 0.882 . . . . 0.0 112.341 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.71 69.48 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.289 1.036 . . . . 0.0 113.426 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -111.89 -0.03 15.96 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.303 1.441 . . . . 0.0 113.442 179.398 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -164.79 78.06 0.33 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.05 1.74 . . . . 0.0 111.921 -175.094 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -64.0 -23.91 67.51 Favored 'General case' 0 CA--C 1.549 0.909 0 O-C-N 119.945 -1.722 . . . . 0.0 112.879 -179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 t -75.11 -7.87 54.98 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.878 1.671 . . . . 0.0 114.323 177.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -100.47 84.31 2.76 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.309 1.444 . . . . 0.0 110.376 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -90.06 171.15 9.75 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.078 1.351 . . . . 0.0 112.253 171.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 138.77 -75.53 0.37 Allowed Glycine 0 N--CA 1.474 1.176 0 C-N-CA 125.398 1.475 . . . . 0.0 112.609 175.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.528 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.4 OUTLIER -57.68 -26.29 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 118.481 1.141 . . . . 0.0 112.026 176.681 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.52 -35.3 39.97 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.692 0.797 . . . . 0.0 112.979 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -59.42 -59.36 5.58 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-O 118.967 -0.539 . . . . 0.0 111.588 171.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.528 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.16 -36.32 83.68 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.039 0.836 . . . . 0.0 112.707 -175.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.8 tm0? -51.72 -54.59 26.67 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.139 1.376 . . . . 0.0 110.791 167.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -57.52 -50.68 72.28 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 117.97 -1.014 . . . . 0.0 112.497 176.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 30.8 mm -52.17 -48.67 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.757 1.223 . . . . 0.0 111.556 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -67.51 -44.22 78.95 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.416 -0.803 . . . . 0.0 112.744 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.8 -37.84 83.34 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.084 0.953 . . . . 0.0 112.819 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -79.34 -34.24 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.021 0.928 . . . . 0.0 112.472 170.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -61.5 -37.22 82.88 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.957 1.253 . . . . 0.0 113.342 177.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -15.62 63.4 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.971 -1.081 . . . . 0.0 112.733 175.743 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 3.9 t -131.28 39.01 3.58 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.924 2.089 . . . . 0.0 112.222 -176.045 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 16.0 mt -51.34 147.99 9.44 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 124.218 1.007 . . . . 0.0 112.48 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -65.19 156.43 63.01 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 122.706 2.271 . . . . 0.0 112.49 -172.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -59.24 -24.88 63.56 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 12.7 t -63.0 -51.74 65.69 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.338 0.972 . . . . 0.0 111.875 175.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.7 p -72.89 -39.28 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 O-C-N 121.857 -0.527 . . . . 0.0 111.353 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -57.38 -50.18 73.81 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.11 0.868 . . . . 0.0 111.734 173.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -66.03 -43.43 87.6 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.934 1.243 . . . . 0.0 112.126 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -63.46 -33.63 75.99 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 120.57 -1.331 . . . . 0.0 113.067 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.22 -22.69 22.63 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.208 1.003 . . . . 0.0 113.151 178.124 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -56.99 -14.8 3.93 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 126.865 2.066 . . . . 0.0 114.137 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -23.96 55.84 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.132 1.773 . . . . 0.0 113.741 166.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -166.73 105.91 0.25 Allowed Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.337 0.97 . . . . 0.0 114.123 -176.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -132.12 63.91 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 126.588 1.955 . . . . 0.0 112.318 -174.378 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 47.84 74.76 0.23 Allowed Glycine 0 CA--C 1.544 1.847 0 C-N-CA 125.825 1.678 . . . . 0.0 113.588 -175.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -69.99 124.33 10.88 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.858 3.039 . . . . 0.0 112.624 -172.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -159.81 71.98 0.5 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.392 1.477 . . . . 0.0 111.666 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 11.5 t -131.19 78.17 73.17 Favored Pre-proline 0 N--CA 1.481 1.08 0 C-N-CA 124.568 1.147 . . . . 0.0 110.53 176.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -76.06 -5.24 16.1 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.862 3.041 . . . . 0.0 114.509 177.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.215 0 C-N-CA 127.371 2.268 . . . . 0.0 112.752 176.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 . . . . . 0 N--CA 1.477 0.901 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -152.18 95.05 2.01 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.581 1.552 . . . . 0.0 111.448 -178.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.2 p -69.46 158.23 87.39 Favored Pre-proline 0 N--CA 1.478 0.944 0 O-C-N 121.012 -1.055 . . . . 0.0 112.668 172.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -68.86 166.86 24.92 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.354 2.702 . . . . 0.0 112.244 176.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -64.88 116.51 3.86 Favored 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 123.025 2.483 . . . . 0.0 111.478 176.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -70.44 -22.59 28.76 Favored 'Trans proline' 0 CA--C 1.554 1.478 0 C-N-CA 122.041 1.827 . . . . 0.0 116.279 166.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -70.19 167.75 24.09 Favored 'Trans proline' 0 C--N 1.363 1.3 0 CA-C-N 124.078 2.492 . . . . 0.0 112.913 179.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -61.37 126.77 20.07 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.934 2.423 . . . . 0.0 110.467 172.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -56.73 -43.43 80.65 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 122.062 -0.399 . . . . 0.0 110.644 173.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.468 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.0 pt? -72.59 16.09 0.16 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 126.778 2.031 . . . . 0.0 116.453 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.34 106.71 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.804 2.041 . . . . 0.0 114.724 -174.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.87 30.59 0.17 Allowed Glycine 0 CA--C 1.537 1.458 0 C-N-CA 124.885 1.231 . . . . 0.0 114.837 -172.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -124.72 157.5 65.71 Favored Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 125.487 1.515 . . . . 0.0 111.925 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.412 ' O ' HG23 ' A' ' 18' ' ' VAL . 77.4 Cg_endo -73.18 168.15 25.48 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.304 2.669 . . . . 0.0 112.858 -179.383 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -52.9 -37.47 60.66 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.667 1.187 . . . . 0.0 113.224 -178.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -57.92 -37.97 75.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.13 1.372 . . . . 0.0 112.643 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 84.6 t -80.12 -40.37 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.116 1.366 . . . . 0.0 111.481 173.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 14' ' ' PRO . 32.2 t -57.02 -37.31 54.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.493 0.717 . . . . 0.0 111.15 178.038 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.9 tppt? -59.26 -50.18 75.0 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 120.545 -1.347 . . . . 0.0 112.223 174.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.15 -46.92 87.12 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.434 0.693 . . . . 0.0 111.263 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -51.97 60.24 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.145 0.978 . . . . 0.0 112.154 170.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -59.56 -47.49 85.36 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.609 1.095 . . . . 0.0 112.789 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -63.92 -37.04 85.93 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.583 0.753 . . . . 0.0 111.932 177.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.7 tp -66.38 -43.92 84.59 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.406 0.682 . . . . 0.0 112.166 173.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.71 -49.1 69.72 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.927 1.291 . . . . 0.0 113.543 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.3 pttt -56.31 -30.75 62.94 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.234 0.925 . . . . 0.0 113.017 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -65.92 -40.65 91.62 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.739 2.016 . . . . 0.0 112.345 174.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -109.73 28.28 8.72 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.568 1.947 . . . . 0.0 112.671 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -66.62 -24.65 66.34 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 119.888 -1.757 . . . . 0.0 112.374 -175.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.7 p -80.22 4.24 18.19 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 127.729 2.411 . . . . 0.0 114.361 177.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -87.51 170.92 10.92 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.431 1.492 . . . . 0.0 112.167 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.82 172.17 8.51 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.851 2.061 . . . . 0.0 111.643 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -51.16 -58.65 9.75 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.063 1.345 . . . . 0.0 112.591 176.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -68.67 -32.04 24.79 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 121.436 1.424 . . . . 0.0 113.128 178.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -65.89 -46.76 77.18 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 121.03 -1.044 . . . . 0.0 112.547 178.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 90.3 mt -65.66 -53.43 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 123.216 0.606 . . . . 0.0 109.555 175.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.09 -36.68 77.93 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 118.122 0.419 . . . . 0.0 112.007 -173.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.4 tttm -57.06 -57.07 14.17 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 126.008 1.723 . . . . 0.0 112.695 171.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -60.82 -40.43 92.71 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 122.871 0.468 . . . . 0.0 111.835 -177.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.725 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.1 mm? -59.01 -51.11 71.47 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.12 0.968 . . . . 0.0 111.101 171.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -62.93 -31.76 72.91 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.29 -52.01 67.08 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.58 0.752 . . . . 0.0 112.372 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.725 ' HE1' HD13 ' A' ' 40' ' ' LEU . 10.6 p-90 -73.29 -30.97 63.77 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 172.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.413 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -59.13 -31.76 46.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.072 1.349 . . . . 0.0 112.596 174.023 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -57.83 -21.41 42.23 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 118.717 0.689 . . . . 0.0 112.716 174.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.38 -16.99 22.97 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.35 1.06 . . . . 0.0 112.941 178.3 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.647 HD11 ' CH2' ' A' ' 43' ' ' TRP . 22.8 mt -62.22 -63.04 1.36 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 178.004 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.29 101.46 0.76 Allowed Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.162 0.887 . . . . 0.0 112.138 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 161.35 -154.6 25.62 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.959 1.266 . . . . 0.0 112.145 -177.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -55.31 -19.81 9.69 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.894 1.277 . . . . 0.0 113.434 177.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -53.47 -23.2 9.48 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.58 1.952 . . . . 0.0 114.48 172.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -34.56 67.95 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.338 1.055 . . . . 0.0 113.286 173.681 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.0 -36.6 83.73 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.203 1.001 . . . . 0.0 110.953 176.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.41 ' HA ' HG22 ' A' ' 57' ' ' THR . 0.0 OUTLIER -63.0 -35.11 79.13 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 117.704 -1.141 . . . . 0.0 112.429 171.344 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -66.72 -54.06 26.96 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 120.148 1.34 . . . . 0.0 112.331 174.665 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -59.82 -43.07 94.74 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 122.145 -0.347 . . . . 0.0 111.556 -178.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.41 HG22 ' HA ' ' A' ' 54' ' ' LYS . 0.7 OUTLIER -70.2 -38.39 75.32 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.202 1.001 . . . . 0.0 112.602 177.503 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -56.59 -53.43 57.74 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.958 1.303 . . . . 0.0 110.511 174.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.64 -50.17 44.22 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.517 0.727 . . . . 0.0 110.892 -179.255 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.6 mmtm -61.95 -55.41 29.79 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.668 1.587 . . . . 0.0 113.573 175.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -54.24 -49.98 68.25 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.639 1.176 . . . . 0.0 112.142 179.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.9 tmm? -64.31 -51.74 61.97 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 123.982 0.913 . . . . 0.0 112.537 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 23.5 mttm -54.49 -34.99 62.63 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.22 -51.55 30.0 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.943 0.792 . . . . 0.0 111.722 178.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.8 -50.06 75.38 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.093 0.957 . . . . 0.0 110.832 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.07 -51.08 70.69 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.151 1.38 . . . . 0.0 112.133 178.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.8 -50.39 72.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 120.166 1.348 . . . . 0.0 112.555 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.67 -50.73 71.31 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.705 0.802 . . . . 0.0 112.475 178.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.1 tp -55.07 -49.65 71.11 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.213 1.405 . . . . 0.0 111.258 175.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.78 -44.16 97.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.825 1.25 . . . . 0.0 111.592 178.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.0 tttp -57.52 -50.22 73.8 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.773 1.17 . . . . 0.0 111.983 175.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.31 -49.7 74.59 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.662 0.785 . . . . 0.0 112.751 176.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.4 m80 -54.76 -50.84 67.44 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.635 0.774 . . . . 0.0 111.572 173.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -53.7 -47.92 70.04 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.836 1.654 . . . . 0.0 112.887 176.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.17 -48.43 73.77 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.014 0.926 . . . . 0.0 112.122 174.113 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.04 77.78 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 50.3 t -69.6 -26.03 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 126.167 1.787 . . . . 0.0 112.365 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.22 -31.78 44.92 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 173.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.3 pttt -93.2 -1.19 56.49 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 176.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -90.85 -81.37 0.31 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.425 1.09 . . . . 0.0 110.711 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.64 153.71 80.79 Favored Pre-proline 0 N--CA 1.481 1.078 0 C-N-CA 126.96 2.104 . . . . 0.0 113.273 -173.435 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.59 -48.24 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.828 3.018 . . . . 0.0 113.191 -178.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -66.73 -34.41 77.77 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.284 1.034 . . . . 0.0 112.389 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.71 -34.62 78.62 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.568 0.747 . . . . 0.0 111.921 178.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.33 -53.31 52.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 118.996 0.816 . . . . 0.0 109.837 170.034 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.1 mttt -59.84 -47.39 85.91 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.358 0.663 . . . . 0.0 111.053 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.63 -54.46 46.22 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.431 1.092 . . . . 0.0 113.43 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.41 -35.73 79.86 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.2 -0.937 . . . . 0.0 112.488 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.45 -45.78 71.57 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 121.473 -0.767 . . . . 0.0 110.941 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -52.62 -51.96 57.63 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.193 0.997 . . . . 0.0 111.261 168.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 7.0 tp -58.65 -37.18 75.41 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 119.286 0.948 . . . . 0.0 112.042 177.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.7 t -70.18 -48.23 58.11 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.066 -1.021 . . . . 0.0 112.581 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 ptpt -69.5 -36.28 76.33 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.789 0.836 . . . . 0.0 111.671 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.2 tp -72.34 -32.04 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 118.629 0.649 . . . . 0.0 111.77 176.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.27 -21.54 65.29 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 -177.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.26 15.15 19.39 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.708 1.603 . . . . 0.0 113.236 176.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -57.51 119.85 7.25 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.215 1.406 . . . . 0.0 113.728 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -102.33 -47.35 4.52 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.372 -0.83 . . . . 0.0 112.296 176.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 t -123.56 -0.93 8.59 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.403 1.481 . . . . 0.0 113.983 177.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.3 mp -67.83 161.29 26.57 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.719 1.207 . . . . 0.0 112.037 177.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -96.34 179.15 5.13 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.351 1.06 . . . . 0.0 111.054 176.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.87 56.64 2.2 Favored Glycine 0 N--CA 1.471 1.032 0 C-N-CA 125.571 1.558 . . . . 0.0 113.934 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.559 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -52.63 -24.42 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 125.778 1.631 . . . . 0.0 112.884 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.91 -35.35 6.36 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.35 1.06 . . . . 0.0 112.738 174.455 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.8 pttt -57.35 -53.48 57.63 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.356 1.462 . . . . 0.0 112.494 171.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.559 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -69.03 -33.77 74.15 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 120.294 1.406 . . . . 0.0 111.895 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -59.09 -54.7 44.07 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 173.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.0 pttm -59.38 -42.77 92.45 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.529 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.5 mm -55.72 -48.52 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.325 1.05 . . . . 0.0 111.256 175.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -62.3 -45.35 93.66 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.237 1.381 . . . . 0.0 112.609 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.22 -35.47 81.16 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.584 0.754 . . . . 0.0 112.525 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.3 pt -79.31 -36.29 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 118.737 0.699 . . . . 0.0 112.208 170.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -59.15 -41.04 87.38 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.278 1.431 . . . . 0.0 112.024 179.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.7 -14.49 63.05 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.193 -0.942 . . . . 0.0 113.306 176.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.6 t -132.56 26.57 4.4 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.087 1.755 . . . . 0.0 113.936 -175.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.458 HD22 HG11 ' A' ' 120' ' ' VAL . 13.0 mt -47.43 145.79 3.77 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 125.809 1.644 . . . . 0.0 112.465 -178.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -63.82 155.52 63.34 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.629 2.219 . . . . 0.0 111.688 -177.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -58.47 -25.54 62.39 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.608 -0.682 . . . . 0.0 112.801 175.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.7 m -61.56 -51.61 67.87 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.38 1.445 . . . . 0.0 112.197 177.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.458 HG11 HD22 ' A' ' 116' ' ' LEU . 9.4 p -75.3 -38.77 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.752 -0.593 . . . . 0.0 111.793 178.28 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -57.69 -48.33 79.83 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 118.911 0.778 . . . . 0.0 111.999 172.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.68 -39.55 73.47 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.511 1.05 . . . . 0.0 112.806 178.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -66.31 -34.81 78.83 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.675 1.125 . . . . 0.0 112.442 177.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.65 -21.55 25.22 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.108 0.963 . . . . 0.0 113.219 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -55.17 -22.09 15.94 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.657 1.583 . . . . 0.0 113.864 179.184 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 26.2 mttm -56.28 -34.48 66.48 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 126.659 1.983 . . . . 0.0 113.076 170.169 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -174.41 133.96 2.67 Favored Glycine 0 CA--C 1.537 1.43 0 C-N-CA 124.193 0.901 . . . . 0.0 114.424 -178.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -114.69 66.91 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 126.92 2.088 . . . . 0.0 111.358 -169.294 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 47.99 74.84 0.22 Allowed Glycine 0 CA--C 1.54 1.628 0 C-N-CA 126.168 1.842 . . . . 0.0 113.245 -173.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -67.81 136.55 39.0 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.074 2.516 . . . . 0.0 111.812 -175.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -145.05 100.54 3.5 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.157 1.383 . . . . 0.0 110.397 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 17.4 t -123.73 75.79 56.07 Favored Pre-proline 0 N--CA 1.476 0.84 0 C-N-CA 124.671 1.188 . . . . 0.0 109.728 177.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -73.93 -7.67 20.27 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.584 2.856 . . . . 0.0 114.213 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.288 0 C-N-CA 126.906 2.082 . . . . 0.0 111.898 -179.106 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 CA--C 1.54 0.562 0 CA-C-O 121.548 0.69 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -149.93 165.66 31.94 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.128 1.771 . . . . 0.0 110.605 169.333 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.1 p -64.43 158.99 63.06 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 123.674 0.79 . . . . 0.0 112.261 171.002 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -68.36 164.11 33.84 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.888 2.392 . . . . 0.0 111.833 177.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -64.04 116.72 3.88 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 123.313 2.675 . . . . 0.0 111.731 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.25 -21.98 26.13 Favored 'Trans proline' 0 CA--C 1.554 1.478 0 C-N-CA 122.171 1.914 . . . . 0.0 116.5 167.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -70.28 166.53 27.92 Favored 'Trans proline' 0 C--N 1.362 1.268 0 CA-C-N 124.25 2.554 . . . . 0.0 112.873 178.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.31 126.86 19.49 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.814 2.343 . . . . 0.0 110.418 173.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -60.31 -33.81 72.9 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 119.807 -0.757 . . . . 0.0 111.419 174.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.458 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.6 pt? -77.91 17.26 0.6 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.33 2.252 . . . . 0.0 115.902 172.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -38.49 105.37 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.029 1.731 . . . . 0.0 114.922 -173.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 147.69 24.17 0.08 OUTLIER Glycine 0 CA--C 1.539 1.581 0 C-N-CA 124.864 1.221 . . . . 0.0 115.296 -172.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.96 158.97 46.53 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 125.098 1.359 . . . . 0.0 112.542 -173.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.415 ' O ' HG23 ' A' ' 18' ' ' VAL . 88.5 Cg_endo -73.46 167.29 27.67 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.196 2.598 . . . . 0.0 112.755 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -50.99 -40.7 58.57 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.503 1.521 . . . . 0.0 113.264 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -56.93 -37.48 71.55 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.48 1.512 . . . . 0.0 113.058 176.057 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.0 t -81.77 -41.11 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 125.0 1.32 . . . . 0.0 111.634 174.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 14' ' ' PRO . 39.6 t -57.5 -36.94 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 123.956 0.902 . . . . 0.0 111.34 178.166 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.5 tptt -64.03 -43.22 96.26 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 172.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.77 -45.42 94.4 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.347 0.659 . . . . 0.0 110.54 175.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.76 -46.29 84.75 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-O 117.475 -1.25 . . . . 0.0 113.646 171.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.56 -47.02 83.26 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 120.192 1.36 . . . . 0.0 112.739 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.34 -38.25 88.78 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.02 0.928 . . . . 0.0 111.621 177.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.0 tp -63.89 -46.97 82.5 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 122.898 0.479 . . . . 0.0 111.46 171.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.44 -45.76 92.5 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.117 1.367 . . . . 0.0 114.443 -178.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -58.41 -28.26 65.05 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.664 1.12 . . . . 0.0 113.608 175.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -76.28 -32.61 58.9 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.503 1.521 . . . . 0.0 113.59 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -108.08 19.6 19.77 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.368 1.467 . . . . 0.0 114.197 176.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -57.79 -28.79 64.32 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 119.948 -1.72 . . . . 0.0 113.247 -177.078 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.7 m -77.18 -2.27 33.62 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.379 1.872 . . . . 0.0 113.767 179.098 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -83.21 167.28 17.85 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.381 1.472 . . . . 0.0 112.613 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.0 172.78 9.31 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 126.556 1.942 . . . . 0.0 112.213 177.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -50.77 -59.89 6.55 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 126.159 1.784 . . . . 0.0 112.913 175.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.8 -32.65 29.17 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.636 1.558 . . . . 0.0 112.974 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.65 -49.98 71.09 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.05 -1.032 . . . . 0.0 112.517 177.183 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 94.1 mt -61.93 -53.53 46.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 123.215 0.606 . . . . 0.0 110.228 174.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -58.52 -40.36 82.7 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 118.319 0.509 . . . . 0.0 112.342 -174.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.31 -54.22 49.22 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.412 1.885 . . . . 0.0 112.479 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.96 -41.12 97.63 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.404 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.738 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.9 mm? -59.36 -51.07 71.48 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 124.007 0.923 . . . . 0.0 113.033 171.735 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.61 -36.06 79.65 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 176.264 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.52 -50.33 73.42 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.159 0.89 . . . . 0.0 112.231 -177.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.738 ' HE1' HD13 ' A' ' 40' ' ' LEU 0.268 8.5 p-90 -69.24 -36.99 77.74 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 170.982 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.425 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -58.2 -31.19 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 125.109 1.364 . . . . 0.0 113.62 176.961 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -57.24 -17.66 12.6 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 175.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.35 -15.47 20.71 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.178 1.391 . . . . 0.0 113.689 176.058 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.677 HD11 ' CH2' ' A' ' 43' ' ' TRP . 32.6 mt -66.68 -61.23 2.08 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 118.899 0.772 . . . . 0.0 112.869 175.621 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.49 104.08 1.1 Allowed Glycine 0 CA--C 1.532 1.154 0 C-N-CA 124.007 0.813 . . . . 0.0 112.188 -177.034 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 166.73 -166.91 39.33 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.508 1.528 . . . . 0.0 111.724 -177.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -56.29 -18.26 10.11 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.42 1.088 . . . . 0.0 113.758 178.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -52.7 -27.81 19.11 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.752 2.021 . . . . 0.0 113.681 174.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -55.07 -36.55 65.73 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.061 1.344 . . . . 0.0 113.299 173.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.51 -52.49 64.28 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.389 1.075 . . . . 0.0 110.523 174.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.84 -42.91 48.4 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 117.244 -1.36 . . . . 0.0 112.009 172.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -55.33 -52.82 62.26 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.657 1.117 . . . . 0.0 112.425 173.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -58.94 -41.12 86.63 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.776 -0.577 . . . . 0.0 112.487 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.67 -43.61 72.18 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.212 1.005 . . . . 0.0 113.373 175.293 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.36 -47.05 73.06 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.664 1.186 . . . . 0.0 110.663 174.131 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.1 ttpp -52.8 -51.37 61.06 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.639 0.654 . . . . 0.0 111.633 -178.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.65 -53.53 53.19 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.329 1.052 . . . . 0.0 113.604 173.196 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.92 -49.44 75.61 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.413 1.006 . . . . 0.0 112.142 -178.533 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -65.03 -51.57 60.82 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.608 1.163 . . . . 0.0 112.348 177.519 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 22.0 mtmt -54.97 -34.06 62.98 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.994 0.815 . . . . 0.0 112.668 172.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.39 -48.31 50.7 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 119.693 1.133 . . . . 0.0 111.767 178.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.45 -52.27 65.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.013 0.925 . . . . 0.0 110.66 177.097 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.01 -49.89 76.18 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.873 1.269 . . . . 0.0 112.259 178.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.1 -45.45 94.65 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.339 0.972 . . . . 0.0 112.014 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -63.43 -49.78 72.36 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 118.762 0.71 . . . . 0.0 111.674 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.8 mt -56.27 -50.02 72.55 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.045 1.338 . . . . 0.0 111.36 174.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -64.08 -41.68 97.22 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 118.569 -0.729 . . . . 0.0 112.249 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -59.2 -50.61 73.35 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.792 1.178 . . . . 0.0 111.719 176.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.79 -50.07 73.82 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.119 0.967 . . . . 0.0 113.091 175.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -57.05 -52.31 65.78 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 118.716 -0.659 . . . . 0.0 111.515 174.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -55.12 -44.16 74.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.537 1.535 . . . . 0.0 112.908 177.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.59 -52.32 64.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.246 1.019 . . . . 0.0 112.709 172.286 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.2 -33.34 75.17 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.534 0.606 . . . . 0.0 112.505 177.102 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 56.0 t -72.65 -25.46 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.242 1.817 . . . . 0.0 112.301 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.45 -33.02 58.78 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 175.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.4 pttt -90.25 -0.69 57.74 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.511 1.524 . . . . 0.0 114.289 173.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 tpp -95.26 -159.22 0.7 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.612 1.965 . . . . 0.0 111.89 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.38 156.84 20.09 Favored Pre-proline 0 N--CA 1.478 0.953 0 C-N-CA 126.313 1.845 . . . . 0.0 114.334 176.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -71.75 -43.04 1.42 Allowed 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.85 3.034 . . . . 0.0 113.537 -175.684 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -58.98 -36.59 75.13 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.668 1.187 . . . . 0.0 111.765 174.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.86 -42.47 90.38 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.488 0.715 . . . . 0.0 110.321 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.91 -46.45 71.44 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.302 1.041 . . . . 0.0 111.799 173.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -62.97 -51.95 64.88 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.509 1.123 . . . . 0.0 112.083 178.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.07 -55.66 30.22 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.47 0.708 . . . . 0.0 112.02 176.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.75 -31.17 71.64 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.98 77.1 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.751 1.16 . . . . 0.0 111.275 171.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -42.59 94.63 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 174.428 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.412 ' HA ' HG22 ' A' ' 94' ' ' ILE . 3.4 mm? -63.97 -39.41 94.06 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 118.979 0.808 . . . . 0.0 113.121 174.273 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.0 t -71.6 -39.59 70.42 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 120.952 -1.092 . . . . 0.0 111.856 -177.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.04 -37.57 64.26 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 118.831 -0.604 . . . . 0.0 112.17 176.478 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.412 HG22 ' HA ' ' A' ' 91' ' ' LEU . 10.4 tt -72.99 -32.25 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 119.133 0.879 . . . . 0.0 112.972 177.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.78 -22.69 64.35 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -94.17 -9.58 35.93 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.142 1.377 . . . . 0.0 113.613 173.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -144.18 92.06 2.28 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.234 1.814 . . . . 0.0 113.302 -174.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -70.59 -8.16 49.49 Favored 'General case' 0 CA--C 1.55 0.98 0 O-C-N 120.588 -1.32 . . . . 0.0 114.545 173.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.6 t -72.73 -11.6 60.68 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.382 1.473 . . . . 0.0 114.269 178.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 45.8 mt -72.8 165.8 24.15 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.634 1.573 . . . . 0.0 112.925 177.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -73.85 177.07 5.79 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.823 1.249 . . . . 0.0 112.582 174.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.03 44.26 0.54 Allowed Glycine 0 N--CA 1.474 1.214 0 C-N-CA 126.027 1.775 . . . . 0.0 114.593 173.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -59.75 -34.96 57.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 118.807 1.303 . . . . 0.0 110.901 -178.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -55.66 -37.62 68.5 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.775 1.23 . . . . 0.0 113.009 -174.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -61.25 -58.7 7.23 Favored 'General case' 0 C--N 1.346 0.45 0 C-N-CA 124.627 1.171 . . . . 0.0 112.428 170.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.96 77.62 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.057 1.343 . . . . 0.0 113.312 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -56.6 -52.19 65.8 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.091 1.356 . . . . 0.0 111.527 168.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.88 -48.04 64.26 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 118.791 -0.624 . . . . 0.0 111.675 173.552 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.1 mm -58.31 -52.22 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 118.849 0.749 . . . . 0.0 111.407 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -63.57 -36.98 85.58 Favored 'General case' 0 C--O 1.242 0.683 0 O-C-N 121.501 -0.749 . . . . 0.0 112.782 178.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.64 -41.54 83.69 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.312 -1.328 . . . . 0.0 113.016 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.4 pt -75.14 -33.31 28.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 O-C-N 121.464 -0.773 . . . . 0.0 110.95 177.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -63.89 -48.38 76.87 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.235 -0.915 . . . . 0.0 111.598 176.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 12.2 mmtp -61.77 -25.03 67.22 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.224 1.01 . . . . 0.0 112.414 174.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 25.3 m -70.11 -44.7 68.43 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 118.836 0.744 . . . . 0.0 112.071 176.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 27.0 mt -60.06 151.39 66.17 Favored Pre-proline 0 CA--C 1.549 0.904 0 C-N-CA 124.047 0.939 . . . . 0.0 112.736 -178.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -67.52 157.51 61.42 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.804 2.336 . . . . 0.0 112.608 -175.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -22.04 66.86 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.539 -0.726 . . . . 0.0 112.523 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 49.9 m -64.91 -48.62 73.51 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 173.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.1 p -74.88 -37.16 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 119.002 0.819 . . . . 0.0 110.485 177.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -57.6 -50.41 73.22 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.963 0.801 . . . . 0.0 111.991 171.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -63.23 -44.0 96.51 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.49 1.041 . . . . 0.0 112.996 178.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -66.59 -32.83 74.41 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.482 -0.761 . . . . 0.0 112.714 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.92 -22.79 21.81 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.192 0.997 . . . . 0.0 113.682 178.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -52.77 -40.93 63.61 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.719 1.608 . . . . 0.0 111.953 176.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.08 6.48 47.53 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.682 1.593 . . . . 0.0 114.672 174.156 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -100.73 82.1 0.49 Allowed Glycine 0 CA--C 1.533 1.179 0 C-N-CA 126.508 2.004 . . . . 0.0 112.753 -177.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -128.09 68.38 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 125.852 1.661 . . . . 0.0 110.961 -176.534 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 53.45 75.22 0.24 Allowed Glycine 0 CA--C 1.561 2.916 0 C-N-CA 126.124 1.821 . . . . 0.0 110.965 176.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.11 164.16 33.69 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 122.507 2.138 . . . . 0.0 112.133 -175.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -154.72 109.32 3.01 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.625 1.97 . . . . 0.0 111.081 -178.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 32.1 t -137.05 132.04 18.04 Favored Pre-proline 0 N--CA 1.48 1.056 0 C-N-CA 125.877 1.671 . . . . 0.0 110.211 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -72.27 174.93 10.69 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 123.974 3.116 . . . . 0.0 113.129 175.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.286 0 N-CA-C 113.809 1.041 . . . . 0.0 113.809 174.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 . . . . . 0 CA--C 1.538 0.518 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -64.26 166.45 8.0 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.781 0.833 . . . . 0.0 111.978 170.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -58.43 154.79 31.29 Favored Pre-proline 0 N--CA 1.473 0.708 0 C-N-CA 123.875 0.87 . . . . 0.0 112.695 173.32 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -67.7 168.69 17.75 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 123.363 2.709 . . . . 0.0 112.276 178.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -64.95 116.01 3.59 Favored 'Trans proline' 0 CA--C 1.545 1.035 0 C-N-CA 122.896 2.397 . . . . 0.0 111.678 175.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -70.39 -23.47 27.89 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 CA-C-O 115.292 -2.045 . . . . 0.0 115.927 164.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -72.3 167.72 26.14 Favored 'Trans proline' 0 C--N 1.362 1.282 0 CA-C-N 124.596 2.677 . . . . 0.0 113.017 179.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -63.35 127.2 19.42 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.991 2.461 . . . . 0.0 112.053 177.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -62.32 -14.78 43.03 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 172.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.432 HD13 ' N ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -118.96 36.01 4.61 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 129.029 2.932 . . . . 0.0 112.409 177.236 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.89 109.82 0.19 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.682 1.593 . . . . 0.0 113.123 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.23 -19.4 1.37 Allowed Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.749 1.643 . . . . 0.0 114.069 -176.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.9 160.9 81.37 Favored Pre-proline 0 CA--C 1.558 1.276 0 C-N-CA 125.646 1.578 . . . . 0.0 113.753 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -75.68 171.54 18.0 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.921 3.081 . . . . 0.0 113.669 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -53.38 -35.17 60.04 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.619 1.168 . . . . 0.0 113.944 -178.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -54.35 -42.1 69.87 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.51 1.524 . . . . 0.0 112.068 174.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -77.81 -43.0 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 125.355 1.462 . . . . 0.0 112.099 173.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 88.3 t -55.29 -36.82 41.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 118.806 0.73 . . . . 0.0 111.352 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.7 tptm -62.96 -50.49 70.58 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.987 -1.071 . . . . 0.0 112.24 172.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.03 -48.34 73.54 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.467 0.707 . . . . 0.0 111.798 177.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -53.58 -52.42 59.81 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.738 1.215 . . . . 0.0 112.149 171.319 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -60.04 -47.51 85.56 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.571 1.078 . . . . 0.0 113.076 -179.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -63.71 -36.34 83.55 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.676 0.79 . . . . 0.0 111.732 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.7 tp -66.25 -46.06 78.41 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.372 0.669 . . . . 0.0 111.829 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -63.49 -45.97 88.29 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.843 1.257 . . . . 0.0 114.024 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -33.53 70.92 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 120.048 1.295 . . . . 0.0 113.461 177.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -69.1 -33.41 73.46 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.396 1.878 . . . . 0.0 112.95 173.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -107.04 20.34 19.17 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.019 2.128 . . . . 0.0 112.895 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -64.4 -25.51 68.05 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 119.775 -1.828 . . . . 0.0 112.762 -174.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.3 -5.01 59.0 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 127.142 2.177 . . . . 0.0 113.335 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.2 mmtt -76.09 -177.71 4.07 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.332 1.453 . . . . 0.0 112.906 178.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.77 172.77 6.67 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 128.082 2.553 . . . . 0.0 111.705 -177.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -49.96 -59.83 6.23 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 125.28 1.432 . . . . 0.0 112.426 176.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.45 -32.91 18.89 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 121.613 1.542 . . . . 0.0 113.261 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.48 -48.06 81.25 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.063 -1.023 . . . . 0.0 111.955 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 54.2 mt -66.1 -52.27 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.278 0.631 . . . . 0.0 110.02 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -57.08 -41.12 78.26 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.69 0.677 . . . . 0.0 111.814 -177.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -52.35 65.98 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.294 1.438 . . . . 0.0 112.917 174.262 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -62.25 -42.47 99.35 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.638 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.0 mm? -60.1 -49.73 76.49 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.295 1.038 . . . . 0.0 110.979 173.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.8 -35.44 76.5 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 176.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.73 -49.36 76.81 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.447 -0.783 . . . . 0.0 112.339 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.638 ' HE1' HD13 ' A' ' 40' ' ' LEU . 9.9 p-90 -73.17 -32.94 65.15 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 172.074 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -58.39 -30.68 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 125.507 1.523 . . . . 0.0 112.987 174.274 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.84 -19.28 16.57 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 118.803 0.729 . . . . 0.0 112.907 174.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.27 -18.54 22.36 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.799 1.24 . . . . 0.0 113.795 175.178 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.61 HD11 ' CH2' ' A' ' 43' ' ' TRP . 33.0 mt -65.45 -61.98 1.79 Allowed 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 178.236 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.61 98.85 0.73 Allowed Glycine 0 CA--C 1.534 1.234 0 C-N-CA 123.937 0.779 . . . . 0.0 112.211 -177.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 173.66 -166.34 38.57 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 125.266 1.412 . . . . 0.0 111.876 -177.337 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -56.14 -17.97 8.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.688 1.195 . . . . 0.0 113.865 177.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -55.19 -23.28 21.12 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.79 2.036 . . . . 0.0 113.859 173.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.8 pttt -54.58 -37.49 65.58 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.269 1.427 . . . . 0.0 113.07 171.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.74 -52.49 63.02 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.738 0.815 . . . . 0.0 110.077 174.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.82 -45.15 29.51 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 118.126 -0.94 . . . . 0.0 111.998 172.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -56.2 -52.42 64.48 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.835 0.854 . . . . 0.0 112.426 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.08 -44.02 91.85 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.65 -0.656 . . . . 0.0 111.924 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.61 -40.08 92.23 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.975 0.91 . . . . 0.0 113.278 175.461 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.5 -53.23 59.93 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.216 1.006 . . . . 0.0 111.053 172.255 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.0 ttmm -52.61 -52.78 53.82 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.43 0.692 . . . . 0.0 110.734 -174.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 11.4 pttp -65.71 -43.68 88.38 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.359 1.064 . . . . 0.0 113.36 176.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.72 -50.47 73.34 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.808 1.185 . . . . 0.0 111.834 178.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.76 -51.5 66.9 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.653 1.181 . . . . 0.0 111.905 177.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.5 mtmm -57.86 -33.6 68.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.46 -50.15 34.44 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.037 0.835 . . . . 0.0 111.444 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 tttm -57.15 -49.73 75.02 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.654 0.782 . . . . 0.0 110.396 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -62.19 -52.0 65.53 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.72 1.208 . . . . 0.0 112.23 179.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.66 -46.27 90.47 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.803 1.183 . . . . 0.0 112.859 178.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -61.75 -50.16 73.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.527 1.131 . . . . 0.0 111.398 178.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tt -56.7 -51.16 69.86 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.467 1.107 . . . . 0.0 110.685 174.451 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.38 -40.86 97.85 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.982 -178.27 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.1 tttt -59.01 -50.86 72.5 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.384 0.993 . . . . 0.0 111.379 173.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.33 -44.87 86.43 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.268 0.556 . . . . 0.0 111.548 -176.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -60.53 -49.36 77.86 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.798 1.239 . . . . 0.0 110.94 175.484 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.03 -43.21 86.65 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.647 1.112 . . . . 0.0 112.843 175.392 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -55.14 -52.57 62.86 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.43 1.092 . . . . 0.0 112.445 173.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.51 -31.27 71.89 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 175.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.4 t -73.05 -23.76 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.678 1.591 . . . . 0.0 113.382 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.63 -30.77 67.54 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.695 1.369 . . . . 0.0 114.695 177.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -86.09 -2.65 58.52 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.516 1.526 . . . . 0.0 114.219 172.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.9 tpp -96.86 -160.41 0.8 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.407 1.883 . . . . 0.0 111.833 -174.484 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.89 156.64 18.14 Favored Pre-proline 0 N--CA 1.478 0.971 0 C-N-CA 126.735 2.014 . . . . 0.0 113.984 174.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.79 -48.32 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 123.599 2.866 . . . . 0.0 112.858 -176.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -57.13 -32.96 66.89 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.034 1.334 . . . . 0.0 112.269 177.086 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.22 -48.79 74.49 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.474 0.709 . . . . 0.0 110.596 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -54.87 -45.5 74.62 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.713 0.688 . . . . 0.0 111.235 173.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? -54.99 -54.91 36.86 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 118.867 0.758 . . . . 0.0 111.241 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.54 -51.93 67.74 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.956 0.903 . . . . 0.0 113.15 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.4 -40.5 95.93 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -178.629 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.19 -45.11 94.84 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.481 0.712 . . . . 0.0 110.93 174.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -43.88 90.67 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.399 0.545 . . . . 0.0 112.374 172.646 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.63 -36.96 84.5 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 174.439 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 10.3 t -70.67 -42.41 70.77 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.406 1.082 . . . . 0.0 112.987 -178.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -70.5 -44.01 68.51 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.521 -0.737 . . . . 0.0 111.133 175.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.8 tt -68.26 -30.63 48.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 118.697 0.681 . . . . 0.0 112.371 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.06 -33.69 69.31 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 176.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -92.21 -28.29 17.12 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.087 0.955 . . . . 0.0 113.412 173.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -138.36 78.79 1.7 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.873 1.269 . . . . 0.0 112.501 -175.21 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -71.13 -11.12 60.77 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 70.1 m -83.26 -2.82 56.57 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.94 1.696 . . . . 0.0 114.502 175.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 97.5 mt -112.21 84.19 1.93 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.432 1.493 . . . . 0.0 111.826 -178.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -95.23 169.76 9.86 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.989 1.315 . . . . 0.0 112.616 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 123.21 -47.28 1.03 Allowed Glycine 0 N--CA 1.474 1.18 0 C-N-CA 127.143 2.306 . . . . 0.0 112.944 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.535 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -60.66 -25.67 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 CA-C-N 117.889 0.844 . . . . 0.0 112.506 179.384 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -44.94 -38.45 4.69 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.761 1.224 . . . . 0.0 112.994 172.219 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -63.99 -59.38 4.56 Favored 'General case' 0 C--N 1.345 0.394 0 C-N-CA 123.571 0.748 . . . . 0.0 111.031 174.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.535 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -63.16 -33.32 75.22 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.994 0.816 . . . . 0.0 113.071 -178.008 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.74 -53.73 53.04 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.688 1.595 . . . . 0.0 110.805 168.645 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -58.12 -48.12 81.19 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.044 0.937 . . . . 0.0 112.527 175.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 26.9 mm -54.05 -52.05 40.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.666 0.786 . . . . 0.0 110.562 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -66.62 -40.97 89.01 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 118.688 -0.672 . . . . 0.0 112.392 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.82 -40.36 94.99 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.566 1.075 . . . . 0.0 111.122 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 53.3 mt -75.86 -51.76 19.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 C-N-CA 123.983 0.913 . . . . 0.0 110.978 176.496 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -54.46 -46.44 73.34 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 118.879 0.763 . . . . 0.0 112.726 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 15.8 mmtp -65.61 -22.53 66.68 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.811 1.244 . . . . 0.0 112.424 176.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 93.7 m -86.69 -38.11 17.32 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.082 1.353 . . . . 0.0 112.929 177.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 31.9 mt -54.95 153.61 11.26 Favored Pre-proline 0 CA--C 1.553 1.09 0 C-N-CA 124.901 1.28 . . . . 0.0 113.146 176.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.65 158.83 55.72 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.951 2.434 . . . . 0.0 113.01 -176.382 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.04 -24.49 67.73 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.242 -0.911 . . . . 0.0 112.784 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.5 m -60.94 -51.54 68.85 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.248 0.931 . . . . 0.0 112.145 173.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.57 -37.34 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-N 118.529 0.604 . . . . 0.0 111.573 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.2 mtmp? -58.01 -49.89 75.31 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.794 -0.622 . . . . 0.0 111.972 172.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -64.33 -45.08 89.42 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.091 0.86 . . . . 0.0 112.891 177.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -65.63 -32.03 73.38 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.692 0.678 . . . . 0.0 112.744 -179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.19 -21.57 21.07 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 178.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -53.86 -38.22 64.46 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.875 1.27 . . . . 0.0 112.521 179.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.4 ttpt -72.07 -21.7 61.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.128 1.371 . . . . 0.0 113.761 177.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 60.46 -166.79 11.0 Favored Glycine 0 CA--C 1.539 1.591 0 C-N-CA 124.949 1.261 . . . . 0.0 114.391 -174.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -130.91 63.27 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 126.598 1.959 . . . . 0.0 110.947 -173.412 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 50.53 74.8 0.25 Allowed Glycine 0 CA--C 1.54 1.62 0 C-N-CA 126.473 1.987 . . . . 0.0 113.464 -175.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.03 128.56 17.88 Favored 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.364 2.71 . . . . 0.0 111.755 -175.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 47.69 80.58 0.05 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.388 2.275 . . . . 0.0 114.197 -176.251 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 9.3 p -62.16 132.3 93.81 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.212 1.405 . . . . 0.0 111.278 178.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -74.35 174.69 12.09 Favored 'Trans proline' 0 CA--C 1.546 1.109 0 C-N-CA 122.676 2.251 . . . . 0.0 112.888 176.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 . . . . . 0 C--O 1.253 1.255 0 C-N-CA 125.967 1.707 . . . . 0.0 113.06 171.963 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 . . . . . 0 CA--C 1.539 0.528 0 CA-C-O 120.734 0.302 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -150.17 87.34 1.46 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 122.529 1.157 . . . . 0.0 110.246 177.003 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.11 158.15 80.25 Favored Pre-proline 0 CA--C 1.54 0.589 0 C-N-CA 123.827 0.851 . . . . 0.0 112.101 176.367 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -68.18 170.71 13.98 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 123.364 2.71 . . . . 0.0 112.482 177.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -64.82 115.65 3.37 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 122.686 2.257 . . . . 0.0 111.663 173.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -71.65 -19.78 27.51 Favored 'Trans proline' 0 CA--C 1.554 1.486 0 C-N-CA 122.099 1.866 . . . . 0.0 116.11 164.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.48 169.43 20.93 Favored 'Trans proline' 0 C--N 1.362 1.281 0 CA-C-N 124.272 2.561 . . . . 0.0 112.729 177.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -60.1 122.31 11.18 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.858 2.372 . . . . 0.0 110.75 171.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -53.4 -32.62 50.38 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.054 0.542 . . . . 0.0 111.949 172.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.561 HD13 ' H ' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -103.12 38.9 1.66 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 128.312 2.645 . . . . 0.0 113.138 176.859 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.72 112.92 0.48 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.808 1.243 . . . . 0.0 113.296 176.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.5 11.06 0.32 Allowed Glycine 0 CA--C 1.538 1.474 0 C-N-CA 125.296 1.427 . . . . 0.0 115.634 -176.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -111.27 159.8 31.55 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 125.645 1.578 . . . . 0.0 112.846 -171.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -73.53 169.74 21.6 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.298 2.665 . . . . 0.0 113.085 178.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -52.53 -35.19 52.83 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.553 1.141 . . . . 0.0 113.659 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -56.38 -39.07 72.34 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.205 1.402 . . . . 0.0 112.802 174.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.404 HG13 ' HH2' ' A' ' 43' ' ' TRP . 54.5 t -77.91 -44.83 28.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.595 1.158 . . . . 0.0 111.792 171.431 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 94.2 t -54.22 -37.53 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 123.366 0.667 . . . . 0.0 111.468 -178.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.7 tppt? -59.91 -50.57 73.25 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.363 -0.836 . . . . 0.0 112.376 174.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.95 -47.97 83.17 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.044 0.938 . . . . 0.0 111.728 177.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.464 ' CD1' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -53.79 -53.67 49.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.665 0.786 . . . . 0.0 111.433 172.609 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -63.19 -45.1 93.31 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.445 1.02 . . . . 0.0 113.138 -179.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -59.74 -39.17 83.88 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.231 1.013 . . . . 0.0 111.555 177.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.492 HD23 HD22 ' A' ' 40' ' ' LEU . 12.9 tp -68.31 -45.8 71.99 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.148 0.579 . . . . 0.0 111.577 172.599 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.548 HD12 HD21 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -64.2 -45.73 87.0 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 179.759 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -56.88 -31.62 65.03 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 119.649 1.113 . . . . 0.0 112.431 178.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -73.65 -29.34 62.27 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.025 1.33 . . . . 0.0 111.744 175.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -109.81 23.7 14.03 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.045 1.738 . . . . 0.0 112.549 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -22.09 66.57 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 119.904 -1.747 . . . . 0.0 113.687 -175.502 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.0 p -92.88 4.11 54.48 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 128.803 2.841 . . . . 0.0 114.307 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -85.75 179.9 6.97 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.329 1.452 . . . . 0.0 111.858 178.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.22 171.27 7.71 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.284 2.234 . . . . 0.0 111.562 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -52.13 -57.62 14.51 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 124.625 1.17 . . . . 0.0 112.338 176.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.9 -33.19 27.16 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.516 1.477 . . . . 0.0 113.319 178.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.23 -47.14 80.83 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.166 -0.959 . . . . 0.0 112.603 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.4 mt -68.44 -53.28 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.089 0.556 . . . . 0.0 109.651 175.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -56.93 -35.84 69.52 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 119.023 -0.513 . . . . 0.0 112.068 -175.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 34.7 tttt -56.97 -58.32 8.66 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.194 1.798 . . . . 0.0 113.434 172.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -59.06 -40.06 84.0 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 122.962 0.505 . . . . 0.0 111.084 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.803 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.1 mm? -60.26 -50.33 74.08 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.369 1.068 . . . . 0.0 111.253 173.271 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.56 -33.25 71.19 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.62 -51.86 68.14 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.603 -0.686 . . . . 0.0 112.213 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.803 ' HE1' HD13 ' A' ' 40' ' ' LEU . 13.4 p-90 -73.8 -30.77 62.92 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 172.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.452 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -60.11 -32.15 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 O-C-N 120.781 -1.2 . . . . 0.0 112.677 174.427 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -58.0 -19.24 29.46 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 118.565 0.62 . . . . 0.0 112.268 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.89 -14.89 21.49 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.878 1.271 . . . . 0.0 113.222 177.273 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.643 HD11 ' CH2' ' A' ' 43' ' ' TRP . 22.8 mt -62.27 -65.94 0.61 Allowed 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 118.99 0.814 . . . . 0.0 112.528 175.551 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.32 104.59 0.67 Allowed Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.015 0.817 . . . . 0.0 111.807 -177.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 163.28 -163.29 35.45 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 125.181 1.372 . . . . 0.0 111.495 -176.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -57.58 -18.24 18.54 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.99 1.316 . . . . 0.0 113.439 -178.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -55.55 -21.65 18.06 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.072 2.149 . . . . 0.0 113.973 171.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.0 ptmt -55.05 -35.07 64.11 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.575 1.55 . . . . 0.0 113.613 171.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.81 -40.67 92.1 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.833 0.853 . . . . 0.0 111.27 174.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.17 -42.32 94.71 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 117.612 -1.185 . . . . 0.0 111.887 170.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -58.43 -52.85 63.89 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 120.406 1.457 . . . . 0.0 112.9 174.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -60.75 -42.11 96.76 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.811 -0.556 . . . . 0.0 111.621 -178.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.19 -34.83 63.88 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.816 0.846 . . . . 0.0 112.584 -179.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -57.35 -52.76 64.07 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 125.298 1.439 . . . . 0.0 111.095 172.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.35 -44.55 65.27 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.269 0.356 . . . . 0.0 110.786 -176.538 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 24.1 mmtt -61.68 -57.16 13.07 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.106 1.762 . . . . 0.0 114.277 171.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -55.37 -50.24 70.22 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.422 1.089 . . . . 0.0 112.376 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -63.98 -51.9 62.15 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 124.183 0.993 . . . . 0.0 112.298 178.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -52.83 -39.12 62.2 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.329 173.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.08 -51.42 54.67 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.023 0.829 . . . . 0.0 111.885 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.4 mttm -58.87 -51.67 69.01 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.013 0.925 . . . . 0.0 111.272 175.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.22 -52.63 64.78 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.809 1.244 . . . . 0.0 111.963 177.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.83 -52.75 63.87 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.827 1.194 . . . . 0.0 112.863 178.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -62.85 -48.99 76.64 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.323 0.649 . . . . 0.0 112.314 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tp -54.84 -49.66 70.52 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.964 1.306 . . . . 0.0 111.171 174.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.22 -43.6 98.62 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.515 1.126 . . . . 0.0 111.729 178.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -58.25 -50.76 72.42 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.588 1.085 . . . . 0.0 111.954 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.96 -48.5 78.63 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.539 1.136 . . . . 0.0 112.633 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -57.3 -54.24 49.08 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.879 0.872 . . . . 0.0 110.979 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -40.99 72.87 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.998 1.319 . . . . 0.0 113.041 177.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.02 -52.63 64.71 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.479 0.712 . . . . 0.0 112.424 172.447 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.04 -31.49 72.05 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 176.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 62.8 t -73.04 -23.84 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 126.016 1.726 . . . . 0.0 112.63 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.78 -32.66 63.66 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.684 -1.26 . . . . 0.0 114.159 176.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -87.92 0.45 55.85 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.527 1.531 . . . . 0.0 114.551 174.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.3 mmt -94.57 -159.82 0.73 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.734 1.614 . . . . 0.0 111.254 -178.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.8 156.43 6.66 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.209 2.203 . . . . 0.0 114.038 173.512 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -69.38 -45.49 1.77 Allowed 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 123.692 2.928 . . . . 0.0 112.726 -176.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -59.67 -31.32 69.44 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.143 0.977 . . . . 0.0 112.223 176.248 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -66.03 -49.23 68.46 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.191 0.596 . . . . 0.0 110.283 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.02 -46.88 61.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.891 0.877 . . . . 0.0 110.714 172.482 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -58.93 -54.91 41.85 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.734 0.814 . . . . 0.0 111.162 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.69 -47.84 84.47 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.541 0.736 . . . . 0.0 112.75 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.85 -40.05 83.73 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.08 -45.74 92.19 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 119.455 1.025 . . . . 0.0 110.742 174.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.62 -44.05 89.86 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.117 0.967 . . . . 0.0 112.219 173.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.8 tp -63.96 -36.66 84.71 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 121.576 -0.703 . . . . 0.0 112.539 171.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.7 t -72.28 -39.35 68.39 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 120.357 -1.464 . . . . 0.0 112.899 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -71.16 -43.51 67.36 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.732 0.813 . . . . 0.0 110.989 175.599 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 7.3 tt -70.17 -32.13 49.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 118.588 0.631 . . . . 0.0 112.446 178.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.18 -30.21 64.32 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -92.46 0.78 57.47 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.256 1.422 . . . . 0.0 114.526 177.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -138.1 106.92 5.93 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.655 1.582 . . . . 0.0 113.411 -173.174 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -81.53 -22.74 37.7 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 178.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -84.42 -2.23 56.86 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.703 1.601 . . . . 0.0 114.284 176.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.0 mt -77.5 167.2 22.04 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 122.239 1.019 . . . . 0.0 113.37 172.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -80.02 165.29 22.71 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.708 1.603 . . . . 0.0 112.281 171.142 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -82.04 60.84 4.75 Favored Glycine 0 N--CA 1.468 0.797 0 C-N-CA 125.924 1.726 . . . . 0.0 113.034 178.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.36 -30.04 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.985 0.914 . . . . 0.0 112.172 179.239 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.07 -38.98 8.63 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.688 1.595 . . . . 0.0 113.101 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.78 -59.5 5.33 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.314 173.593 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -63.74 -33.69 76.22 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.735 0.698 . . . . 0.0 111.7 -176.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -60.14 -47.91 83.93 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.288 1.035 . . . . 0.0 111.817 173.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -46.35 91.08 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 118.403 -0.808 . . . . 0.0 111.665 174.29 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 24.9 mm -53.19 -49.81 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 125.123 1.369 . . . . 0.0 111.194 174.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -63.31 -44.17 95.71 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.98 1.264 . . . . 0.0 112.603 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.24 -49.03 79.23 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 122.707 0.403 . . . . 0.0 111.151 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.4 pp -70.99 -31.98 46.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 118.289 -0.863 . . . . 0.0 112.497 174.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -60.47 -42.78 96.91 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 120.345 1.43 . . . . 0.0 111.904 178.154 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -75.58 -11.72 60.07 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 174.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 33.2 p -130.72 48.9 2.37 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.382 1.473 . . . . 0.0 112.795 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.498 HD23 ' CG1' ' A' ' 120' ' ' VAL . 0.9 OUTLIER -54.0 149.88 16.61 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 123.898 0.879 . . . . 0.0 111.407 179.713 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.35 150.74 84.39 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.308 2.005 . . . . 0.0 111.684 -177.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -62.79 -22.5 66.66 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 176.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.9 m -62.61 -51.64 66.52 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.911 1.232 . . . . 0.0 112.256 174.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.498 ' CG1' HD23 ' A' ' 116' ' ' LEU . 9.4 p -73.6 -38.81 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 O-C-N 121.755 -0.591 . . . . 0.0 111.163 178.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 29.6 mmtt -58.31 -49.29 77.69 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.53 -0.731 . . . . 0.0 111.922 174.188 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -66.68 -43.56 84.14 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.445 1.02 . . . . 0.0 113.024 177.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -64.98 -36.74 85.39 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.368 -0.832 . . . . 0.0 112.429 179.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.67 -22.03 26.34 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.288 1.035 . . . . 0.0 113.128 179.313 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -52.91 -34.07 53.45 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.703 1.601 . . . . 0.0 112.132 179.27 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -80.49 -38.11 30.47 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.908 1.283 . . . . 0.0 113.547 175.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 143.96 179.08 20.22 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.781 1.657 . . . . 0.0 114.078 -179.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.88 66.86 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 126.251 1.82 . . . . 0.0 111.74 -173.048 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 47.5 74.79 0.22 Allowed Glycine 0 CA--C 1.543 1.787 0 C-N-CA 126.09 1.805 . . . . 0.0 113.789 -175.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.95 128.69 17.17 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.527 2.818 . . . . 0.0 112.008 -174.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -158.92 109.96 2.08 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.918 1.687 . . . . 0.0 110.197 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 5.5 p -95.24 137.27 22.16 Favored Pre-proline 0 N--CA 1.474 0.74 0 C-N-CA 124.238 1.015 . . . . 0.0 110.514 174.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -73.42 -10.5 23.96 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.771 2.314 . . . . 0.0 114.687 176.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.171 0 C-N-CA 125.264 1.426 . . . . 0.0 113.723 -177.172 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.55 0.951 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -91.81 0.75 57.47 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.249 1.419 . . . . 0.0 113.489 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.6 p -101.52 162.93 18.92 Favored Pre-proline 0 N--CA 1.475 0.822 0 C-N-CA 127.125 2.17 . . . . 0.0 112.825 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -70.59 170.05 18.5 Favored 'Trans proline' 0 CA--C 1.544 0.99 0 C-N-CA 123.481 2.787 . . . . 0.0 112.223 176.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -66.64 116.67 4.22 Favored 'Trans proline' 0 CA--C 1.547 1.125 0 C-N-CA 123.145 2.564 . . . . 0.0 111.88 172.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -71.23 -23.58 24.22 Favored 'Trans proline' 0 CA--C 1.554 1.476 0 C-N-CA 122.32 2.013 . . . . 0.0 116.888 167.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -71.97 168.91 22.62 Favored 'Trans proline' 0 C--N 1.361 1.232 0 CA-C-N 124.26 2.557 . . . . 0.0 113.156 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -61.93 130.08 29.72 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.831 2.354 . . . . 0.0 110.988 173.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -55.04 -42.53 72.77 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.922 0.868 . . . . 0.0 111.632 174.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.545 ' H ' HD23 ' A' ' 10' ' ' LEU . 2.2 pt? -78.73 17.02 0.75 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 127.991 2.516 . . . . 0.0 115.363 177.312 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -33.25 103.61 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 127.24 2.216 . . . . 0.0 115.325 -173.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.45 32.87 0.11 Allowed Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.095 1.331 . . . . 0.0 114.548 -172.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -125.23 157.79 66.12 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 125.621 1.568 . . . . 0.0 112.021 -175.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -74.44 169.08 23.32 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.065 2.51 . . . . 0.0 113.053 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -53.55 -37.29 62.74 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.65 1.18 . . . . 0.0 113.465 -177.149 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -57.27 -37.68 72.74 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.278 1.431 . . . . 0.0 112.671 176.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.0 t -82.65 -38.2 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.401 1.481 . . . . 0.0 112.194 174.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.1 t -57.56 -39.33 68.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.936 0.894 . . . . 0.0 110.742 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.5 tptm -61.13 -50.58 72.61 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.653 -1.28 . . . . 0.0 111.799 173.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -53.83 -47.27 71.09 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.237 0.615 . . . . 0.0 112.268 176.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -51.9 -52.97 46.11 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.388 1.075 . . . . 0.0 112.081 169.272 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -47.47 85.77 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.953 0.901 . . . . 0.0 113.331 -177.428 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.81 -38.89 92.79 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.422 0.689 . . . . 0.0 111.529 177.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 14.0 tp -63.71 -44.49 93.49 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 122.938 0.495 . . . . 0.0 111.969 172.244 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.58 -34.88 78.79 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.887 1.275 . . . . 0.0 113.871 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.9 mmtt -54.66 -32.95 59.97 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.844 1.202 . . . . 0.0 113.991 174.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.9 ttpp -69.1 -38.56 79.0 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.88 1.272 . . . . 0.0 112.715 172.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -104.17 14.35 30.6 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.709 1.604 . . . . 0.0 113.245 -172.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -22.3 41.58 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 120.33 -1.481 . . . . 0.0 114.694 -175.161 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.7 p -103.67 1.16 31.56 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 127.123 2.169 . . . . 0.0 114.847 179.472 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -76.81 170.65 16.08 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.39 1.476 . . . . 0.0 111.96 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.29 171.76 12.42 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.888 1.675 . . . . 0.0 111.915 175.27 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -50.97 -59.72 6.99 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 124.75 1.22 . . . . 0.0 112.218 174.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.547 ' HA ' ' HG3' ' A' ' 37' ' ' GLU . 59.2 Cg_endo -67.03 -28.86 41.11 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.296 1.997 . . . . 0.0 113.479 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -67.53 -50.05 60.51 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.064 -1.648 . . . . 0.0 112.586 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.7 mt -62.97 -53.4 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 CA-C-N 118.662 0.665 . . . . 0.0 110.022 176.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.547 ' HG3' ' HA ' ' A' ' 34' ' ' PRO . 2.0 pp20? -55.33 -42.33 73.65 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 117.866 -1.064 . . . . 0.0 111.244 -177.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -57.56 -51.39 69.69 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-N 119.672 1.124 . . . . 0.0 112.066 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -40.74 96.63 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.725 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.2 mm? -61.13 -51.12 70.41 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.687 0.795 . . . . 0.0 111.789 172.116 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.85 -30.45 71.51 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.149 -0.97 . . . . 0.0 113.106 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.16 -49.05 78.8 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.129 -0.982 . . . . 0.0 112.346 178.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.725 ' HE1' HD13 ' A' ' 40' ' ' LEU . 10.8 p-90 -73.72 -35.52 65.11 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 173.062 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.618 HG23 HD12 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -59.65 -30.68 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 124.898 1.279 . . . . 0.0 112.401 176.813 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -57.27 -14.51 4.48 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.909 0.884 . . . . 0.0 112.912 174.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.79 -12.11 16.0 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.645 1.578 . . . . 0.0 113.833 176.837 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.678 HD11 ' CH2' ' A' ' 43' ' ' TRP . 17.5 mt -67.67 -54.38 20.07 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 176.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -154.2 -153.08 6.3 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 125.441 1.496 . . . . 0.0 111.224 -169.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.42 13.57 5.4 Favored Glycine 0 CA--C 1.528 0.899 0 N-CA-C 116.49 1.356 . . . . 0.0 116.49 -172.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -112.04 -35.1 5.77 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.396 1.479 . . . . 0.0 111.988 175.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -76.21 -26.83 56.5 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.18 0.592 . . . . 0.0 111.974 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -53.84 -35.04 61.05 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.613 1.565 . . . . 0.0 114.126 172.023 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.06 -50.71 67.32 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.221 0.608 . . . . 0.0 110.342 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -48.96 -46.34 43.28 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 117.525 -1.226 . . . . 0.0 111.864 170.095 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -55.55 -48.05 75.37 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 119.869 1.213 . . . . 0.0 112.981 174.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -58.05 -46.44 85.39 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.456 1.025 . . . . 0.0 112.246 178.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.7 -41.62 83.3 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.744 1.218 . . . . 0.0 114.078 178.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -72.79 -43.29 62.97 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 121.214 -0.929 . . . . 0.0 113.075 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -53.17 -51.02 63.38 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.873 0.869 . . . . 0.0 111.253 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.1 pttp -63.46 -43.23 97.96 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 118.5 -0.762 . . . . 0.0 112.355 175.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -57.53 -47.41 82.08 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 119.639 1.109 . . . . 0.0 112.635 173.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -61.08 -53.5 56.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.829 1.252 . . . . 0.0 111.989 178.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.9 mtmt -60.14 -31.89 70.51 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 119.032 -0.509 . . . . 0.0 112.344 175.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.43 -51.47 23.74 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.837 0.744 . . . . 0.0 111.455 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -58.76 -49.29 78.19 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.744 0.817 . . . . 0.0 110.791 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -60.96 -52.27 65.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.773 1.229 . . . . 0.0 112.131 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.8 -44.7 96.35 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 119.797 1.18 . . . . 0.0 113.258 179.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -67.53 -45.08 76.77 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.456 0.703 . . . . 0.0 111.954 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.01 -51.23 70.1 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.119 0.967 . . . . 0.0 110.949 170.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.4 -42.93 99.52 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.057 -179.049 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -56.31 -50.76 70.53 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.558 1.072 . . . . 0.0 111.965 173.212 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.55 82.05 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -60.65 -49.44 77.51 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.049 0.94 . . . . 0.0 111.046 176.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.63 -42.64 83.79 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.086 1.354 . . . . 0.0 112.993 175.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -56.25 -52.59 63.91 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.324 1.05 . . . . 0.0 112.171 172.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.88 -31.52 72.17 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 177.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.1 t -73.06 -24.8 21.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 125.812 1.645 . . . . 0.0 113.086 176.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.65 -30.59 65.54 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 177.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.2 1.28 54.8 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.729 1.611 . . . . 0.0 114.406 172.639 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.3 ttm -103.53 -158.57 0.67 Allowed 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 126.429 1.891 . . . . 0.0 111.558 -172.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.76 156.11 36.65 Favored Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 125.179 1.391 . . . . 0.0 113.958 178.393 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.65 -43.86 1.21 Allowed 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 123.44 2.76 . . . . 0.0 113.084 -176.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -58.97 -34.3 71.65 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.329 1.052 . . . . 0.0 112.107 175.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.72 -43.59 88.61 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 122.998 0.519 . . . . 0.0 110.241 177.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -42.82 77.26 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.219 1.008 . . . . 0.0 112.056 173.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -59.83 -54.29 47.99 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.466 1.107 . . . . 0.0 111.563 175.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.43 -51.52 69.53 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.232 1.013 . . . . 0.0 113.085 178.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.6 -34.83 76.45 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 179.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.35 -51.67 68.95 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.46 1.027 . . . . 0.0 109.92 172.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -52.93 -51.96 59.5 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.808 0.843 . . . . 0.0 111.947 173.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.27 -37.86 84.65 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.7 t -72.98 -37.72 66.92 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.282 1.033 . . . . 0.0 112.541 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -38.86 56.73 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 121.706 -0.621 . . . . 0.0 111.694 177.35 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 12.0 tt -70.71 -31.62 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 119.148 0.886 . . . . 0.0 112.778 175.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.11 -33.38 67.28 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -88.25 -28.28 21.22 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.147 0.979 . . . . 0.0 113.559 171.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -126.58 88.08 2.77 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.025 1.73 . . . . 0.0 112.465 -172.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.89 -8.41 15.34 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 176.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.2 t -66.38 -17.12 64.59 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.232 1.413 . . . . 0.0 114.428 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 5.6 mt -82.58 84.26 7.31 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.008 1.723 . . . . 0.0 110.945 -178.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -88.82 154.53 20.19 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.285 1.034 . . . . 0.0 111.61 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 66.89 7.46 42.94 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.771 1.177 . . . . 0.0 115.761 -178.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -61.22 -28.47 43.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 118.75 1.275 . . . . 0.0 112.911 -170.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -48.52 -38.93 21.58 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.411 1.085 . . . . 0.0 113.36 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -59.3 -59.35 5.6 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.845 0.858 . . . . 0.0 111.626 174.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.89 -33.38 75.69 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -177.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.59 -51.02 71.68 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.645 1.178 . . . . 0.0 110.53 171.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -52.75 -51.88 58.78 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 117.715 -1.136 . . . . 0.0 111.095 172.326 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 10.4 mm -53.68 -48.5 60.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.284 0.947 . . . . 0.0 111.582 177.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -65.08 -44.11 89.99 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.31 -0.869 . . . . 0.0 113.209 178.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.08 78.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.951 0.9 . . . . 0.0 112.126 177.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.49 -37.15 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 122.853 0.461 . . . . 0.0 111.891 175.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -58.42 -44.12 88.97 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 119.458 1.026 . . . . 0.0 112.194 176.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 8.1 mmtt -67.41 -15.7 63.82 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.554 1.142 . . . . 0.0 113.475 176.134 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 59.2 p -106.09 3.14 27.78 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.58 1.152 . . . . 0.0 113.961 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 51.4 mt -65.34 157.48 77.51 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 124.762 1.225 . . . . 0.0 113.393 177.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -71.67 161.86 43.9 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 123.414 2.743 . . . . 0.0 112.932 177.13 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -63.98 -24.89 67.89 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.547 -0.721 . . . . 0.0 112.865 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.9 t -61.22 -51.64 68.14 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.229 -0.919 . . . . 0.0 111.981 177.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.1 p -73.97 -38.12 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 121.737 -0.602 . . . . 0.0 112.051 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.47 -48.84 76.26 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.073 0.851 . . . . 0.0 111.706 171.69 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -67.93 -42.5 80.94 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.306 0.957 . . . . 0.0 112.96 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -65.99 -34.25 77.67 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.137 0.881 . . . . 0.0 112.592 177.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.08 -22.82 25.18 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 178.361 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -55.07 -31.13 60.93 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.511 1.525 . . . . 0.0 113.011 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -59.07 -31.56 68.98 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.246 1.018 . . . . 0.0 112.58 173.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 70.14 38.76 72.93 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 125.072 1.32 . . . . 0.0 114.705 176.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER 37.44 52.51 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 C-N-CA 128.059 2.544 . . . . 0.0 114.222 178.057 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 61.1 74.81 0.34 Allowed Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.64 1.59 . . . . 0.0 112.342 -174.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -73.79 -29.09 10.84 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.614 2.876 . . . . 0.0 112.584 -170.059 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -160.0 114.08 2.24 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 127.227 2.211 . . . . 0.0 109.349 172.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 41.0 t -95.46 130.71 31.36 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 124.699 1.2 . . . . 0.0 109.613 176.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -70.13 174.28 10.06 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 123.549 2.833 . . . . 0.0 112.775 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.212 0 C-N-CA 124.023 0.929 . . . . 0.0 113.267 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 34.3 t70 . . . . . 0 N--CA 1.472 0.633 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.7 -153.38 0.2 Allowed 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 125.585 1.554 . . . . 0.0 113.161 176.198 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.86 158.49 72.29 Favored Pre-proline 0 N--CA 1.478 0.961 0 C-N-CA 125.637 1.575 . . . . 0.0 111.721 171.432 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -68.12 167.68 21.2 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.47 2.78 . . . . 0.0 113.124 178.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -64.46 126.38 16.81 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 123.953 3.102 . . . . 0.0 111.633 175.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -67.64 -24.77 41.14 Favored 'Trans proline' 0 CA--C 1.554 1.497 0 C-N-CA 122.669 2.246 . . . . 0.0 116.492 167.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.6 166.36 26.16 Favored 'Trans proline' 0 C--N 1.361 1.223 0 CA-C-N 124.093 2.497 . . . . 0.0 112.8 175.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 35.0 Cg_endo -59.15 131.3 40.54 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 123.099 2.533 . . . . 0.0 111.626 171.546 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -48.4 -47.22 37.87 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.415 0.686 . . . . 0.0 111.818 170.068 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.56 ' H ' HD23 ' A' ' 10' ' ' LEU . 1.8 pt? -83.47 18.06 1.96 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 126.6 1.96 . . . . 0.0 115.219 -178.577 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -32.92 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 127.018 2.127 . . . . 0.0 115.611 -172.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.09 27.71 0.17 Allowed Glycine 0 CA--C 1.537 1.453 0 C-N-CA 124.814 1.197 . . . . 0.0 114.448 -172.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.79 157.45 59.84 Favored Pre-proline 0 CA--C 1.552 1.036 0 C-N-CA 125.722 1.609 . . . . 0.0 111.663 -175.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -73.36 168.37 24.94 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.114 2.543 . . . . 0.0 112.923 -178.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -54.76 -38.24 66.97 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.532 1.133 . . . . 0.0 113.464 -177.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.76 -40.9 66.61 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.517 1.527 . . . . 0.0 112.428 173.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.1 t -80.69 -39.52 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 124.812 1.245 . . . . 0.0 111.683 176.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 59.5 t -56.28 -40.91 68.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.077 0.951 . . . . 0.0 111.105 177.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.7 tptm -61.28 -50.69 72.01 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 121.132 -0.98 . . . . 0.0 111.968 173.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -53.36 -47.58 69.29 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.531 0.733 . . . . 0.0 112.042 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.428 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -52.06 -53.79 38.02 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.676 1.191 . . . . 0.0 112.156 169.742 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.33 -47.61 84.77 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.27 0.941 . . . . 0.0 113.533 -178.305 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -68.61 -28.76 67.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.477 0.711 . . . . 0.0 112.295 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.3 tp -68.75 -48.53 63.51 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 121.56 -0.713 . . . . 0.0 111.668 165.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.71 -34.65 73.18 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.652 1.581 . . . . 0.0 113.905 -178.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -30.72 47.42 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.924 1.238 . . . . 0.0 113.099 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.4 -34.33 70.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.882 1.673 . . . . 0.0 112.372 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -109.85 16.84 21.73 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.952 2.101 . . . . 0.0 113.15 -175.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -20.59 56.65 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 119.974 -1.704 . . . . 0.0 114.529 -174.309 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.1 m -102.24 0.77 34.95 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.849 2.06 . . . . 0.0 113.086 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -74.33 175.96 7.15 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.23 1.412 . . . . 0.0 111.875 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.65 174.7 6.86 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.4 1.88 . . . . 0.0 111.902 175.62 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.78 -60.69 3.84 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 126.539 1.935 . . . . 0.0 112.774 172.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.85 -33.77 25.88 Favored 'Trans proline' 0 C--N 1.357 1.014 0 C-N-CA 121.881 1.721 . . . . 0.0 113.284 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -65.06 -46.16 82.32 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.118 -0.989 . . . . 0.0 112.224 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 66.7 mt -67.73 -53.29 32.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 122.931 0.493 . . . . 0.0 110.371 175.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -56.38 -38.33 71.3 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 118.403 0.547 . . . . 0.0 111.835 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -58.19 -57.17 14.02 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 125.227 1.411 . . . . 0.0 113.016 173.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -65.8 -35.47 80.79 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.756 0.312 . . . . 0.0 111.672 -175.224 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.779 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.7 mm? -64.54 -49.46 71.16 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.977 1.311 . . . . 0.0 111.732 170.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.26 -41.0 71.61 Favored 'General case' 0 N--CA 1.465 0.319 0 O-C-N 121.177 -0.952 . . . . 0.0 113.303 174.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.64 -48.7 71.95 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -175.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.779 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.1 p-90 -72.92 -36.01 67.16 Favored 'General case' 0 CA--C 1.554 1.119 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 168.568 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -32.85 39.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 125.258 1.423 . . . . 0.0 112.364 175.537 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -60.1 -15.63 25.04 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.827 0.851 . . . . 0.0 112.762 177.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 21.5 m -100.88 -17.99 16.58 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.414 1.486 . . . . 0.0 112.614 176.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.69 HD11 ' CH2' ' A' ' 43' ' ' TRP . 17.8 mt -63.73 -52.16 61.7 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 178.238 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -176.9 -166.75 34.4 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 123.73 0.681 . . . . 0.0 112.558 -165.121 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -122.95 12.69 8.61 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 125.603 1.573 . . . . 0.0 114.5 -175.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -106.05 -32.65 8.19 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.664 2.385 . . . . 0.0 112.46 173.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -71.95 -22.23 61.48 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 121.317 -0.864 . . . . 0.0 112.482 176.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.99 -34.31 59.46 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.373 1.469 . . . . 0.0 114.248 171.242 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.98 -38.61 82.92 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.625 0.77 . . . . 0.0 111.717 178.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.44 -44.89 92.83 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.425 -0.797 . . . . 0.0 111.551 169.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -57.57 -47.82 81.04 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.253 0.933 . . . . 0.0 113.054 173.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -43.97 90.76 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.646 0.657 . . . . 0.0 111.248 -179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.07 -37.5 66.77 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.011 0.524 . . . . 0.0 112.312 -178.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -63.64 -55.53 22.85 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 123.77 0.828 . . . . 0.0 111.43 174.334 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -54.5 -39.79 67.9 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 118.641 0.655 . . . . 0.0 111.871 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.1 mmtt -59.37 -57.22 13.96 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.925 1.29 . . . . 0.0 113.876 170.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -59.47 -41.87 90.74 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 118.57 0.623 . . . . 0.0 112.381 178.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -51.93 64.02 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 124.866 1.266 . . . . 0.0 112.502 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -55.68 -38.65 69.92 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.918 0.887 . . . . 0.0 111.038 172.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.64 -46.92 67.92 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 123.117 0.567 . . . . 0.0 111.884 -178.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -59.57 -53.26 60.16 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.249 1.02 . . . . 0.0 111.581 175.13 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.2 -38.27 89.94 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.71 -50.85 69.49 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.316 0.962 . . . . 0.0 112.409 175.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.98 -44.61 84.42 Favored 'General case' 0 C--O 1.245 0.816 0 C-N-CA 123.197 0.599 . . . . 0.0 112.037 -178.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 26.6 mt -59.13 -51.29 70.66 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 124.297 1.039 . . . . 0.0 111.788 173.101 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.13 -40.87 97.38 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.996 179.046 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.8 tttm -58.29 -51.11 71.17 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.098 1.317 . . . . 0.0 111.994 174.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.0 -48.77 78.83 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.27 0.628 . . . . 0.0 112.44 177.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -58.87 -50.04 75.51 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.306 1.042 . . . . 0.0 110.941 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.11 -41.72 84.19 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.332 1.453 . . . . 0.0 113.269 175.623 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -55.76 -52.58 63.45 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.55 1.14 . . . . 0.0 112.209 172.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.55 -31.84 72.19 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 54.1 t -73.26 -24.27 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 C-N-CA 125.512 1.525 . . . . 0.0 112.783 176.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.68 -34.62 65.2 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 176.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.9 pttt -84.4 0.18 50.43 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.297 1.439 . . . . 0.0 114.349 174.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.7 ttm -103.0 -159.64 0.74 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.947 2.099 . . . . 0.0 111.445 -173.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -58.72 154.78 34.19 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 125.339 1.456 . . . . 0.0 113.665 178.459 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -68.51 -45.73 2.34 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.573 2.849 . . . . 0.0 112.762 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -33.48 72.63 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.966 1.306 . . . . 0.0 112.893 176.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.97 -48.72 75.32 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 122.795 0.438 . . . . 0.0 110.218 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.2 -44.84 68.28 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.95 173.365 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -59.44 -55.44 34.58 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.522 1.055 . . . . 0.0 110.903 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.89 -51.49 69.38 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.242 0.617 . . . . 0.0 112.251 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.75 -39.25 93.83 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.5 -44.44 94.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.26 0.936 . . . . 0.0 111.104 174.134 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.55 -45.42 88.99 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.502 0.721 . . . . 0.0 112.782 172.07 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.422 ' HA ' HG22 ' A' ' 94' ' ' ILE . 7.8 mp -64.47 -34.77 78.97 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.888 0.767 . . . . 0.0 112.372 173.111 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 15.6 t -70.9 -45.12 64.88 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 120.686 -1.259 . . . . 0.0 112.903 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? -66.47 -49.24 67.28 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.225 0.61 . . . . 0.0 109.987 175.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.422 HG22 ' HA ' ' A' ' 91' ' ' LEU . 9.1 tt -65.32 -32.39 58.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 118.958 0.799 . . . . 0.0 112.509 -176.57 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.34 -19.4 63.31 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -115.48 -22.99 9.02 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 170.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -126.56 79.88 1.89 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.172 1.389 . . . . 0.0 108.888 -177.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -65.16 -31.77 73.12 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.817 1.247 . . . . 0.0 112.386 -178.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.6 m -73.09 -18.07 61.34 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 126.184 1.794 . . . . 0.0 114.53 177.276 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -77.73 84.16 4.07 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 124.834 1.253 . . . . 0.0 109.364 175.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -93.12 -170.29 2.37 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.172 1.789 . . . . 0.0 111.405 173.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 93.38 -59.09 2.28 Favored Glycine 0 N--CA 1.466 0.664 0 C-N-CA 124.949 1.262 . . . . 0.0 111.5 178.513 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.513 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.2 OUTLIER -56.43 -24.35 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 125.079 1.352 . . . . 0.0 113.466 -177.687 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -46.94 -32.49 3.88 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.217 1.407 . . . . 0.0 113.247 169.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -55.56 -60.09 3.91 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.119 0.967 . . . . 0.0 111.336 169.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.513 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -65.99 -34.05 77.22 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.212 -0.93 . . . . 0.0 112.332 -176.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.71 -54.58 42.56 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.866 0.866 . . . . 0.0 110.83 171.374 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -56.06 -52.49 64.08 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 118.375 -0.821 . . . . 0.0 112.062 174.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.9 mm -51.84 -49.19 37.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.208 1.403 . . . . 0.0 111.073 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -67.15 -43.77 81.48 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.683 1.129 . . . . 0.0 112.842 178.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.14 -49.19 78.82 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.83 0.852 . . . . 0.0 111.319 177.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.4 pp -68.76 -37.3 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 118.615 -0.707 . . . . 0.0 112.247 174.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -56.06 -41.05 74.49 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.744 1.218 . . . . 0.0 112.68 177.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -69.02 -18.11 64.0 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 176.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 6.4 t -117.45 22.05 12.67 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.971 1.309 . . . . 0.0 112.907 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 36.4 mt -59.72 151.67 61.54 Favored Pre-proline 0 CA--C 1.546 0.826 0 O-C-N 120.849 -1.157 . . . . 0.0 113.218 177.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -70.16 159.13 54.18 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.377 2.718 . . . . 0.0 112.548 -179.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.06 -23.95 66.8 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.912 176.512 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 61.3 m -68.72 -39.22 80.51 Favored 'General case' 0 C--N 1.352 0.677 0 CA-C-O 117.346 -1.312 . . . . 0.0 114.217 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.3 p -79.6 -37.82 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-N 119.098 0.863 . . . . 0.0 110.189 175.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -57.55 -48.26 79.8 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.126 0.875 . . . . 0.0 111.669 173.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -68.34 -43.01 78.45 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.086 0.857 . . . . 0.0 112.541 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -64.95 -32.87 74.8 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.251 -0.905 . . . . 0.0 112.859 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.406 HD12 ' C ' ' A' ' 124' ' ' LEU . 0.6 OUTLIER -90.86 -19.94 22.83 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.355 1.062 . . . . 0.0 113.418 179.618 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.9 -29.12 55.18 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.084 1.354 . . . . 0.0 112.815 178.548 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 12.6 tmtt? -65.13 -26.13 68.06 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.565 1.546 . . . . 0.0 113.502 174.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -161.38 91.41 0.11 Allowed Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.749 1.166 . . . . 0.0 114.207 -172.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.448 HD13 ' H ' ' A' ' 128' ' ' ILE . 0.1 OUTLIER -88.14 68.02 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 127.229 2.211 . . . . 0.0 112.546 -178.153 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 46.52 77.78 0.1 OUTLIER Glycine 0 CA--C 1.544 1.892 0 C-N-CA 126.834 2.159 . . . . 0.0 113.185 -177.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.02 101.88 1.27 Allowed 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 123.931 3.087 . . . . 0.0 112.689 -171.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -156.87 110.92 2.69 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.207 1.803 . . . . 0.0 111.267 179.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 12.6 p -70.11 132.87 88.01 Favored Pre-proline 0 N--CA 1.476 0.85 0 C-N-CA 124.823 1.249 . . . . 0.0 111.002 173.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -73.15 179.1 5.75 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 123.234 2.623 . . . . 0.0 112.516 176.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 C--O 1.253 1.247 0 C-N-CA 125.224 1.41 . . . . 0.0 113.359 176.002 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo . . . . . 0 CA--C 1.548 1.176 0 CA-C-O 119.032 -0.487 . . . . 0.0 112.043 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -73.7 -19.08 21.65 Favored 'Trans proline' 0 CA--C 1.554 1.493 0 C-N-CA 122.438 2.092 . . . . 0.0 116.604 165.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.78 168.39 23.91 Favored 'Trans proline' 0 C--N 1.362 1.24 0 CA-C-N 124.462 2.629 . . . . 0.0 112.353 176.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -60.44 127.96 24.51 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.673 2.249 . . . . 0.0 111.181 170.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -51.88 -41.71 62.12 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.522 0.677 . . . . 0.0 111.747 168.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.704 ' H ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -95.86 41.87 1.1 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 128.62 2.768 . . . . 0.0 112.954 176.772 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.6 112.68 0.58 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.873 1.269 . . . . 0.0 113.039 174.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.15 -16.45 2.12 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 126.128 1.823 . . . . 0.0 114.236 -177.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.05 160.42 78.37 Favored Pre-proline 0 CA--C 1.558 1.274 0 C-N-CA 125.535 1.534 . . . . 0.0 113.866 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -75.71 171.34 18.38 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.899 3.066 . . . . 0.0 113.545 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -53.86 -36.62 62.82 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.463 1.105 . . . . 0.0 113.785 -176.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -53.4 -42.34 66.87 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.711 1.604 . . . . 0.0 112.551 173.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 77.8 t -77.47 -41.55 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 124.649 1.18 . . . . 0.0 111.673 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.3 t -55.24 -37.81 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 118.641 0.655 . . . . 0.0 111.583 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.0 tptm -62.48 -50.67 70.49 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.245 -0.909 . . . . 0.0 111.865 172.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.49 -46.51 80.43 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.003 0.82 . . . . 0.0 112.515 176.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -53.84 49.17 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.775 0.83 . . . . 0.0 111.527 172.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -64.03 -44.93 91.05 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.521 1.055 . . . . 0.0 113.209 -178.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.42 -37.97 82.57 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.248 1.019 . . . . 0.0 111.589 177.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.445 HD23 HD22 ' A' ' 40' ' ' LEU . 12.6 tp -66.7 -46.02 76.92 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 122.966 0.506 . . . . 0.0 111.259 169.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.628 HD12 HD21 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -64.63 -42.53 95.41 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -178.666 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.36 -29.34 61.29 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.993 1.27 . . . . 0.0 113.361 177.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.7 tttp -72.67 -33.95 66.89 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.686 1.195 . . . . 0.0 112.989 175.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . 0.285 15.9 p30 -109.78 22.1 16.09 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.983 1.313 . . . . 0.0 113.934 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -58.72 -24.54 61.66 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.05 -1.656 . . . . 0.0 113.178 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 31.9 p -96.87 -0.89 47.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 127.522 2.329 . . . . 0.0 114.388 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -77.87 179.72 6.54 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.876 1.671 . . . . 0.0 112.969 173.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.86 171.5 9.56 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.378 2.271 . . . . 0.0 112.503 173.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -59.13 8.76 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 125.413 1.485 . . . . 0.0 112.556 175.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -66.43 -28.41 46.27 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 122.254 1.97 . . . . 0.0 113.65 -178.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -72.71 -39.89 66.6 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.439 -0.788 . . . . 0.0 111.669 -176.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 52.7 mt -70.52 -53.04 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.669 1.188 . . . . 0.0 110.21 171.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -57.97 -36.83 73.14 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 118.39 -0.814 . . . . 0.0 112.051 -176.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -52.79 -57.28 10.7 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.078 1.351 . . . . 0.0 111.77 172.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.38 -41.37 96.99 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.5 0.72 . . . . 0.0 111.691 -177.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.748 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.8 mm? -61.45 -47.45 85.67 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.001 0.92 . . . . 0.0 111.384 174.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -62.46 -38.6 90.43 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.323 1.049 . . . . 0.0 113.105 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.33 -49.93 68.58 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.405 -0.809 . . . . 0.0 112.578 179.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.748 ' HE1' HD13 ' A' ' 40' ' ' LEU . 7.6 p-90 -73.73 -33.93 64.54 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 172.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.549 HG23 HD12 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -58.44 -30.39 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 125.074 1.35 . . . . 0.0 112.82 174.538 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.83 -16.66 18.23 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 118.836 0.743 . . . . 0.0 112.875 176.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.44 -16.21 21.32 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.189 1.396 . . . . 0.0 113.902 173.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.628 HD11 ' CH2' ' A' ' 43' ' ' TRP . 40.2 mt . . . . . 0 N--CA 1.474 0.75 0 CA-C-N 119.024 0.829 . . . . 0.0 112.629 175.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 N--CA 1.476 0.846 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -61.5 -53.32 57.92 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 124.375 1.07 . . . . 0.0 112.156 177.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt -56.08 -35.6 67.16 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.574 0.749 . . . . 0.0 111.661 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.72 -50.57 34.85 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.838 0.855 . . . . 0.0 111.48 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.8 tttt -58.83 -49.71 76.7 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.554 0.742 . . . . 0.0 110.688 176.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -62.31 -49.16 76.74 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.636 0.774 . . . . 0.0 111.954 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.01 -44.55 94.5 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.006 0.821 . . . . 0.0 111.9 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -66.72 -46.27 76.03 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.601 0.761 . . . . 0.0 112.224 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.8 tt -54.93 -51.13 67.06 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.804 0.842 . . . . 0.0 111.166 169.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.52 -40.09 96.13 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 118.553 -0.736 . . . . 0.0 112.176 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -57.77 -50.92 71.63 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.724 1.21 . . . . 0.0 111.929 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.15 -48.56 73.13 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.314 0.646 . . . . 0.0 112.156 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -59.33 -48.91 79.83 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.161 0.984 . . . . 0.0 110.708 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -55.65 -46.36 77.48 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.763 1.225 . . . . 0.0 113.039 173.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -51.69 65.69 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.174 0.897 . . . . 0.0 111.772 176.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.43 -32.93 74.81 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 175.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 48.8 t -72.69 -25.42 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 125.312 1.445 . . . . 0.0 113.139 178.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.85 -29.63 67.1 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.1 ptmt -89.24 -3.19 58.64 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.863 1.665 . . . . 0.0 114.16 172.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.7 tpp -94.74 -163.54 1.06 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.339 1.856 . . . . 0.0 112.018 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -52.64 152.18 7.02 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 126.94 2.096 . . . . 0.0 114.118 172.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -72.52 -39.11 2.89 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.697 2.932 . . . . 0.0 113.876 -174.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -62.86 -33.04 74.44 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.102 -0.999 . . . . 0.0 112.437 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.26 -44.06 92.93 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.902 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.04 -42.63 65.92 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.098 1.359 . . . . 0.0 112.634 173.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.3 mmtm -65.5 -52.62 51.42 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.279 1.432 . . . . 0.0 111.681 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.87 -53.16 60.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.501 0.72 . . . . 0.0 112.16 173.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.31 -36.0 82.69 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.11 -48.48 81.53 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.133 0.879 . . . . 0.0 111.216 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -56.64 -49.58 74.6 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 171.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.2 mt -60.7 -35.17 75.62 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.543 0.737 . . . . 0.0 112.296 178.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.4 t -73.05 -46.55 51.11 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.678 1.191 . . . . 0.0 113.043 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -65.97 -43.03 89.05 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.514 -0.741 . . . . 0.0 110.89 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.1 tt -68.95 -34.62 65.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.88 -18.06 63.81 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 . . . . . 0 N--CA 1.474 0.753 0 C-N-CA 124.282 1.033 . . . . 0.0 113.732 169.592 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.491 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -48.72 -38.06 20.49 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.218 -0.926 . . . . 0.0 112.554 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -58.93 -59.33 5.63 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.289 0.636 . . . . 0.0 111.225 173.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.491 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.64 -35.37 80.79 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.934 0.788 . . . . 0.0 112.623 -176.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 9.0 tm0? -59.09 -46.25 88.77 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.926 0.89 . . . . 0.0 111.554 171.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -50.35 74.03 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.396 -0.812 . . . . 0.0 111.494 173.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 31.0 mm -51.11 -50.84 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 124.793 1.237 . . . . 0.0 110.797 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -64.03 -45.99 86.45 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.604 0.638 . . . . 0.0 112.053 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.15 -44.78 83.75 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.501 0.72 . . . . 0.0 111.8 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 28.0 pt -71.54 -41.11 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-O 118.746 -0.645 . . . . 0.0 112.556 173.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 90.5 t80 . . . . . 0 N--CA 1.474 0.757 0 CA-C-N 120.362 1.437 . . . . 0.0 112.857 -178.329 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 CA--C 1.536 0.609 0 CA-C-O 121.735 0.639 . . . . 0.0 111.975 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -63.2 -23.39 67.41 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.317 -0.865 . . . . 0.0 112.791 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.3 m -62.44 -51.7 66.48 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.318 0.963 . . . . 0.0 112.118 176.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.476 HG22 HD23 ' A' ' 124' ' ' LEU . 10.8 p -72.23 -39.96 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 118.249 0.477 . . . . 0.0 111.414 178.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.82 -46.42 84.73 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.779 173.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -69.18 -40.27 78.19 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.605 1.093 . . . . 0.0 113.438 177.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -68.65 -31.28 70.31 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 121.039 -1.038 . . . . 0.0 113.055 177.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.476 HD23 HG22 ' A' ' 120' ' ' VAL . 0.6 OUTLIER -93.34 -16.95 24.11 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.447 1.099 . . . . 0.0 113.594 178.486 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 N--CA 1.476 0.842 0 C-N-CA 124.939 1.296 . . . . 0.0 112.367 174.945 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo . . . . . 0 CA--C 1.543 0.927 0 CA-C-O 119.29 -0.379 . . . . 0.0 111.648 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.81 -25.29 39.54 Favored 'Trans proline' 0 CA--C 1.551 1.368 0 C-N-CA 122.442 2.095 . . . . 0.0 116.367 167.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.4 163.87 34.85 Favored 'Trans proline' 0 C--N 1.362 1.254 0 CA-C-N 124.116 2.506 . . . . 0.0 112.754 176.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 36.8 Cg_endo -61.4 133.81 48.17 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.9 2.4 . . . . 0.0 111.34 171.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -49.9 -43.67 49.67 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.335 0.654 . . . . 0.0 111.669 169.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.551 HD23 ' H ' ' A' ' 10' ' ' LEU . 1.8 pt? -83.06 18.91 1.53 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.216 1.807 . . . . 0.0 115.102 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.36 105.59 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.625 1.97 . . . . 0.0 115.24 -173.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.28 26.68 0.2 Allowed Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.757 1.17 . . . . 0.0 114.661 -172.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -120.97 156.85 56.33 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 126.198 1.799 . . . . 0.0 112.01 -174.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.404 ' O ' HG23 ' A' ' 18' ' ' VAL . 81.8 Cg_endo -73.45 166.39 29.98 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 123.394 2.73 . . . . 0.0 113.239 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -52.46 -41.02 62.96 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.512 1.525 . . . . 0.0 113.133 -179.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -55.36 -39.54 70.18 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.883 1.673 . . . . 0.0 113.027 175.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 74.8 t -80.35 -40.33 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 124.881 1.273 . . . . 0.0 111.705 175.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 14' ' ' PRO . 54.1 t -55.9 -39.81 58.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.876 0.87 . . . . 0.0 110.987 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -59.72 -50.66 72.96 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 121.002 -1.061 . . . . 0.0 112.178 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.57 -47.02 83.23 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.852 0.861 . . . . 0.0 111.818 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.406 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.9 OUTLIER -51.96 -50.09 61.93 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.498 1.119 . . . . 0.0 111.861 168.182 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -44.82 95.52 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.225 0.92 . . . . 0.0 113.038 -178.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -65.85 -34.86 79.13 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.546 -0.721 . . . . 0.0 111.789 176.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 tp -66.64 -41.05 88.87 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 171.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -72.23 -25.56 61.68 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.5 mmtt -53.62 -46.76 70.55 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.583 1.083 . . . . 0.0 113.051 175.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.0 ptmt -70.06 -24.77 63.3 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 173.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -104.21 17.56 23.88 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 126.761 2.025 . . . . 0.0 113.008 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.68 -19.07 65.52 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.185 -1.572 . . . . 0.0 113.175 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.2 p -98.6 3.41 47.96 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.871 2.469 . . . . 0.0 114.206 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -73.37 179.61 3.89 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.426 1.49 . . . . 0.0 112.802 173.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -117.65 172.49 7.32 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 127.513 2.325 . . . . 0.0 111.227 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.7 -57.62 6.53 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 126.544 1.938 . . . . 0.0 112.826 176.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -69.73 -37.33 9.38 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.349 2.033 . . . . 0.0 113.426 177.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -64.79 -41.57 95.72 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 120.788 -1.195 . . . . 0.0 112.269 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 56.8 mt -67.14 -53.29 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-O 118.431 -0.795 . . . . 0.0 109.428 174.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -57.39 -41.04 79.5 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.555 1.071 . . . . 0.0 112.187 -175.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 6.5 mmpt? -57.14 -60.79 3.08 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.3 1.44 . . . . 0.0 112.806 174.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.14 -33.96 77.27 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -174.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.711 HD13 ' HE1' ' A' ' 43' ' ' TRP . 0.9 OUTLIER -66.93 -50.14 63.31 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 124.649 1.179 . . . . 0.0 111.235 173.488 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -55.28 -39.42 69.84 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.983 0.81 . . . . 0.0 112.912 175.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.36 -50.23 67.97 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.711 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.4 p-90 -73.8 -34.5 64.64 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 169.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -56.56 -32.19 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 125.194 1.397 . . . . 0.0 112.193 174.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.28 -19.27 44.74 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 118.935 0.789 . . . . 0.0 112.686 177.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 48.9 m -89.95 -24.49 21.28 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.983 1.313 . . . . 0.0 112.898 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.707 HD11 ' CH2' ' A' ' 43' ' ' TRP . 37.5 mt . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 13.3 mmt -64.27 -50.02 69.57 Favored 'General case' 0 N--CA 1.462 0.169 0 C-N-CA 123.032 0.533 . . . . 0.0 112.174 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -57.38 -35.02 69.46 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.292 0.637 . . . . 0.0 112.197 175.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.83 -51.5 22.14 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.236 1.014 . . . . 0.0 111.805 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -50.98 70.79 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.758 0.823 . . . . 0.0 110.599 174.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -60.88 -50.43 73.47 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.213 0.605 . . . . 0.0 111.99 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.13 92.95 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.803 0.728 . . . . 0.0 112.65 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -64.02 -50.33 68.9 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.772 0.829 . . . . 0.0 112.088 176.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 42.2 mt -55.66 -51.07 68.48 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.417 1.087 . . . . 0.0 110.724 175.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.428 ' HB1' ' HA ' ' A' ' 92' ' ' SER . . . -54.37 -51.35 65.09 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.118 0.967 . . . . 0.0 113.108 172.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -53.16 -50.74 63.97 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 120.218 1.372 . . . . 0.0 112.268 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.29 -48.85 74.1 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.424 0.689 . . . . 0.0 112.35 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.487 ' O ' HG23 ' A' ' 77' ' ' VAL . 8.9 m-70 -55.57 -52.88 62.27 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 123.804 0.842 . . . . 0.0 110.88 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -52.08 -46.96 65.4 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.997 2.119 . . . . 0.0 112.295 177.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -48.55 78.1 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.848 0.859 . . . . 0.0 112.26 174.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.63 -33.88 76.63 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 173.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 73' ' ' HIS . 92.6 t -69.98 -28.14 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 125.293 1.437 . . . . 0.0 111.925 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.04 -20.2 37.28 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 176.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.91 1.31 26.6 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 126.299 1.84 . . . . 0.0 114.173 173.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 tpp -98.64 -161.59 0.89 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.701 2.001 . . . . 0.0 112.025 -175.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.1 156.5 20.1 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 125.507 1.523 . . . . 0.0 113.942 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.56 -42.55 2.5 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.728 2.952 . . . . 0.0 113.345 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.64 -36.55 83.18 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.899 1.28 . . . . 0.0 112.571 177.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.62 -40.99 89.38 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.756 175.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -56.12 -45.72 79.42 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 117.852 -1.07 . . . . 0.0 112.368 176.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.31 -53.73 50.87 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.375 1.47 . . . . 0.0 111.369 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.63 -55.05 36.66 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.653 0.781 . . . . 0.0 111.885 176.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.25 -32.35 71.5 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -176.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.92 -46.38 89.61 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.023 -1.048 . . . . 0.0 111.856 170.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -58.53 -50.42 73.82 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.445 0.698 . . . . 0.0 111.977 171.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.2 mp -57.83 -34.58 69.83 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.646 0.657 . . . . 0.0 111.833 174.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.428 ' HA ' ' HB1' ' A' ' 70' ' ' ALA . 14.5 t -69.82 -50.83 39.01 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.012 -1.055 . . . . 0.0 112.657 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? -64.71 -40.2 94.94 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 118.677 -0.678 . . . . 0.0 110.898 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.5 tp -70.37 -37.15 69.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 119.224 0.92 . . . . 0.0 111.824 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.93 -21.0 65.13 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -176.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.711 0 C-N-CA 124.903 1.281 . . . . 0.0 113.634 174.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -41.3 -46.43 3.23 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.906 1.682 . . . . 0.0 113.025 170.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -59.67 -59.13 5.92 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.615 0.766 . . . . 0.0 111.617 176.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.23 -35.62 80.9 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.671 0.789 . . . . 0.0 112.833 -175.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -53.86 -50.9 65.25 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 124.784 1.233 . . . . 0.0 110.779 167.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.4 tttt -57.29 -49.2 76.84 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.424 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 9.9 mm -54.74 -48.67 72.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.898 0.879 . . . . 0.0 111.758 176.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -64.5 -45.12 88.65 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.296 0.953 . . . . 0.0 112.844 177.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.51 -48.92 79.79 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.433 1.093 . . . . 0.0 111.822 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -68.88 -38.41 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.061 0.544 . . . . 0.0 112.142 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 63.0 t80 . . . . . 0 N--CA 1.472 0.625 0 CA-C-N 119.61 1.095 . . . . 0.0 113.016 177.418 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo . . . . . 0 N--CA 1.458 -0.585 0 N-CA-C 110.45 -0.634 . . . . 0.0 110.45 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -55.05 -30.46 59.63 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.596 -0.69 . . . . 0.0 111.818 176.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 46.7 p -56.69 -50.73 71.26 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.066 1.746 . . . . 0.0 113.202 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.94 -41.79 94.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 CA-C-N 119.619 1.099 . . . . 0.0 110.507 177.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -62.55 -46.27 89.15 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.356 177.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.52 -37.86 87.97 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.978 1.263 . . . . 0.0 113.244 176.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.74 -37.43 73.46 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.271 -0.893 . . . . 0.0 112.531 177.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -87.02 -19.11 29.14 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.445 1.098 . . . . 0.0 113.272 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.475 0.817 0 C-N-CA 125.789 1.636 . . . . 0.0 112.131 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo . . . . . 0 CA--C 1.544 0.999 0 N-CA-C 110.772 -0.511 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -68.19 -22.54 40.49 Favored 'Trans proline' 0 CA--C 1.552 1.383 0 C-N-CA 122.341 2.027 . . . . 0.0 116.281 167.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -69.89 167.95 23.13 Favored 'Trans proline' 0 C--N 1.362 1.274 0 CA-C-N 124.531 2.654 . . . . 0.0 113.828 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -61.21 119.74 7.05 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 123.629 2.886 . . . . 0.0 111.772 173.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -54.0 -27.87 34.47 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 172.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.478 ' H ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -108.08 35.34 3.18 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 128.122 2.569 . . . . 0.0 112.693 178.426 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -41.93 112.46 0.33 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.475 1.51 . . . . 0.0 114.044 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 151.42 -17.66 0.89 Allowed Glycine 0 CA--C 1.539 1.553 0 C-N-CA 126.588 2.042 . . . . 0.0 113.929 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.14 159.25 65.65 Favored Pre-proline 0 CA--C 1.553 1.089 0 C-N-CA 125.598 1.559 . . . . 0.0 113.919 -175.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.66 172.19 16.71 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.643 2.895 . . . . 0.0 113.27 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -53.65 -34.07 57.37 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.549 1.139 . . . . 0.0 113.438 -179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.62 -36.08 71.31 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.503 1.521 . . . . 0.0 112.65 175.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.46 HG13 ' HH2' ' A' ' 43' ' ' TRP . 43.3 t -79.14 -43.02 24.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 125.113 1.365 . . . . 0.0 111.553 170.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 86.0 t -53.36 -37.9 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 119.035 0.834 . . . . 0.0 111.642 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tppt? -61.14 -51.1 70.49 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.001 -1.062 . . . . 0.0 112.402 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.12 -49.48 76.83 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.668 0.787 . . . . 0.0 111.283 176.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.06 -52.34 44.29 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.33 1.052 . . . . 0.0 111.827 171.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -61.41 -45.47 94.2 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.89 1.223 . . . . 0.0 113.226 -178.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -69.83 -26.42 64.22 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 122.949 0.5 . . . . 0.0 112.282 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -72.84 -54.15 9.56 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.005 0.922 . . . . 0.0 111.903 168.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.22 -43.12 82.54 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.704 1.602 . . . . 0.0 114.131 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.91 -27.11 64.94 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.508 1.049 . . . . 0.0 112.942 175.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -38.08 66.94 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.966 1.706 . . . . 0.0 112.501 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.98 19.47 19.53 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.08 2.152 . . . . 0.0 113.99 177.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -59.23 -23.54 62.4 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 119.595 -1.941 . . . . 0.0 113.418 -176.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.2 p -82.14 2.13 32.94 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 128.929 2.892 . . . . 0.0 115.072 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -93.08 -176.06 4.05 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 126.548 1.939 . . . . 0.0 112.417 173.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.45 167.15 11.17 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.31 2.244 . . . . 0.0 111.745 174.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -43.5 -59.8 3.06 Favored Pre-proline 0 N--CA 1.473 0.705 0 C-N-CA 125.704 1.602 . . . . 0.0 113.313 174.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -66.75 -35.82 26.54 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 121.827 1.684 . . . . 0.0 113.642 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.42 -50.77 71.48 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.686 1.194 . . . . 0.0 111.324 -177.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 10.4 mt -66.94 -48.43 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.3 1.04 . . . . 0.0 112.379 172.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -49.49 -46.07 47.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.643 0.777 . . . . 0.0 110.574 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -52.04 -47.78 64.88 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.508 1.049 . . . . 0.0 113.328 174.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -63.13 -49.16 75.47 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.286 1.034 . . . . 0.0 111.79 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.703 HD13 ' HE1' ' A' ' 43' ' ' TRP . 4.0 mm? -58.75 -48.93 79.52 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.975 0.91 . . . . 0.0 110.433 176.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.439 ' HA ' ' HB ' ' A' ' 44' ' ' VAL . 31.7 m-20 -58.54 -35.29 72.09 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 125.008 1.323 . . . . 0.0 114.297 176.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.15 -53.49 57.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.553 0.615 . . . . 0.0 112.437 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.703 ' HE1' HD13 ' A' ' 40' ' ' LEU . 12.0 p-90 -73.29 -29.75 62.93 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 113.18 0.808 . . . . 0.0 113.18 175.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.703 HG22 HD12 ' A' ' 47' ' ' LEU . 1.6 t -60.22 -33.51 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.301 1.84 . . . . 0.0 113.588 172.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -56.71 -15.24 4.19 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 119.115 0.87 . . . . 0.0 112.818 173.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.18 -6.7 16.28 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.587 1.555 . . . . 0.0 114.147 176.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.703 HD12 HG22 ' A' ' 44' ' ' VAL . 13.6 mt . . . . . 0 N--CA 1.478 0.934 0 CA-C-N 119.671 1.123 . . . . 0.0 113.415 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 . . . . . 0 N--CA 1.475 0.805 0 CA-C-O 120.98 0.419 . . . . 0.0 112.066 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -61.97 -52.8 62.55 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.878 1.271 . . . . 0.0 112.335 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -54.74 -34.65 62.78 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.819 -0.61 . . . . 0.0 112.505 174.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.71 -51.96 24.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.97 0.805 . . . . 0.0 111.933 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -58.84 -47.45 84.81 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.37 0.668 . . . . 0.0 111.482 177.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -60.73 -50.95 71.4 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.739 1.216 . . . . 0.0 112.08 176.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.79 -49.61 74.83 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.773 1.169 . . . . 0.0 112.915 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -62.37 -50.67 70.65 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.878 0.871 . . . . 0.0 112.201 178.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tp -56.04 -50.3 71.33 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.662 0.785 . . . . 0.0 111.156 175.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.88 -45.75 85.9 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.347 1.059 . . . . 0.0 111.915 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.5 tptt -57.48 -48.42 79.25 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.564 1.075 . . . . 0.0 112.425 176.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.84 78.44 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.455 0.702 . . . . 0.0 112.254 176.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.418 ' O ' HG23 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -58.39 -50.0 75.25 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.737 1.215 . . . . 0.0 110.878 178.544 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -51.96 -49.47 63.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 126.382 1.873 . . . . 0.0 112.401 172.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -56.18 -49.08 75.02 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.687 0.795 . . . . 0.0 111.97 178.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.9 -33.41 75.53 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 174.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 73' ' ' HIS . 56.0 t -69.51 -27.54 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.814 1.246 . . . . 0.0 112.679 178.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.16 -28.73 42.19 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 175.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -98.63 -1.76 40.07 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.973 1.709 . . . . 0.0 114.463 175.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -90.24 -84.68 0.23 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.421 1.088 . . . . 0.0 111.251 175.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -129.97 154.21 81.14 Favored Pre-proline 0 N--CA 1.479 1.02 0 C-N-CA 126.508 1.923 . . . . 0.0 112.991 -173.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -69.93 -48.31 0.71 Allowed 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 123.683 2.922 . . . . 0.0 112.611 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -72.66 -33.72 66.75 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.88 -41.55 82.77 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 119.024 -0.513 . . . . 0.0 110.323 174.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.66 -48.98 74.13 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 117.87 -1.062 . . . . 0.0 110.302 173.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -56.38 -54.03 50.36 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.22 0.918 . . . . 0.0 110.736 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.08 -50.82 72.62 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.364 -0.835 . . . . 0.0 113.247 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -67.46 -44.16 79.3 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.815 0.846 . . . . 0.0 112.589 -177.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.86 93.77 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.441 1.097 . . . . 0.0 111.912 173.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.401 ' OE1' ' HE3' ' A' ' 93' ' ' LYS . 0.5 OUTLIER -59.99 -44.02 94.79 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.163 0.585 . . . . 0.0 111.73 174.367 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.442 ' HA ' HG22 ' A' ' 94' ' ' ILE . 1.8 mm? -63.47 -35.05 79.17 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 172.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.3 t -69.6 -47.24 64.17 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.43 1.092 . . . . 0.0 112.485 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.401 ' HE3' ' OE1' ' A' ' 90' ' ' GLU . 1.6 ptpm? -67.95 -41.58 82.25 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.615 0.766 . . . . 0.0 111.157 177.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.442 HG22 ' HA ' ' A' ' 91' ' ' LEU . 7.2 tt -71.07 -32.91 49.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 118.986 0.812 . . . . 0.0 112.6 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.64 -30.36 68.67 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.697 0 C-N-CA 124.755 1.222 . . . . 0.0 113.69 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.41 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.478 0.927 0 CA-C-O 121.432 0.634 . . . . 0.0 112.578 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -31.5 4.42 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.344 1.458 . . . . 0.0 114.078 173.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -62.15 -59.81 4.52 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.115 171.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.41 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -62.33 -35.13 78.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.394 0.997 . . . . 0.0 112.269 -177.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -59.11 -49.45 77.84 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.616 0.766 . . . . 0.0 112.416 172.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.59 -51.84 67.12 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 117.786 -1.102 . . . . 0.0 110.993 172.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 31.3 mm -49.72 -49.91 19.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.619 1.168 . . . . 0.0 111.355 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -62.09 -52.18 64.93 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.693 0.679 . . . . 0.0 111.856 176.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.1 -33.77 71.23 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.9 pt -79.33 -39.76 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 118.161 -0.923 . . . . 0.0 112.069 169.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 93.7 t80 . . . . . 0 N--CA 1.475 0.809 0 CA-C-N 121.308 1.867 . . . . 0.0 113.837 179.401 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo . . . . . 0 CA--C 1.539 0.752 0 CA-C-O 122.243 0.851 . . . . 0.0 112.734 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -59.16 -26.87 65.13 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 173.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 23.5 p -65.59 -50.08 66.41 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 120.027 1.285 . . . . 0.0 112.833 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.4 p -69.06 -39.3 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.42 0.688 . . . . 0.0 111.551 175.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 10.0 mtpt -59.13 -47.05 86.69 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 118.254 -0.879 . . . . 0.0 112.372 171.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -65.98 -41.28 91.35 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 119.971 1.26 . . . . 0.0 112.786 177.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.08 -37.06 80.8 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.986 -1.072 . . . . 0.0 112.835 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.44 -19.13 31.77 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.474 1.109 . . . . 0.0 113.309 178.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 . . . . . 0 N--CA 1.478 0.958 0 C-N-CA 126.492 1.917 . . . . 0.0 113.922 179.729 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo . . . . . 0 CA--C 1.542 0.909 0 CA-C-O 119.338 -0.359 . . . . 0.0 111.578 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -67.21 -26.01 42.56 Favored 'Trans proline' 0 CA--C 1.55 1.321 0 C-N-CA 122.367 2.045 . . . . 0.0 115.928 167.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.66 162.9 39.13 Favored 'Trans proline' 0 C--N 1.362 1.245 0 CA-C-N 123.954 2.448 . . . . 0.0 112.834 177.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -62.12 140.72 85.46 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.066 2.51 . . . . 0.0 111.827 171.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -52.32 -42.09 63.55 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.634 0.73 . . . . 0.0 112.221 171.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.542 HD23 ' H ' ' A' ' 10' ' ' LEU . 1.7 pt? -84.76 19.22 2.11 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.604 1.962 . . . . 0.0 114.873 179.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -34.49 101.5 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.411 2.285 . . . . 0.0 115.548 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.64 29.1 0.14 Allowed Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.058 0.837 . . . . 0.0 114.498 -171.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.04 156.93 59.17 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 125.264 1.426 . . . . 0.0 111.692 -176.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -73.01 169.5 22.05 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.3 2.666 . . . . 0.0 112.777 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -54.12 -38.89 65.92 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.455 1.102 . . . . 0.0 113.423 -177.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.88 -39.24 68.5 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.523 1.529 . . . . 0.0 112.65 174.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.4 t -81.49 -39.63 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 124.899 1.28 . . . . 0.0 111.662 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 49.1 t -55.22 -40.95 58.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.881 0.872 . . . . 0.0 110.847 176.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -60.45 -50.66 72.68 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.929 -1.107 . . . . 0.0 112.378 175.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.24 -48.0 77.36 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.822 0.849 . . . . 0.0 111.855 177.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -50.73 59.46 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.094 0.958 . . . . 0.0 112.025 169.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.51 -47.38 86.4 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.968 0.804 . . . . 0.0 112.362 -177.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -66.48 -32.37 73.69 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.321 0.648 . . . . 0.0 112.096 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.6 tp -66.53 -49.08 67.67 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.563 0.745 . . . . 0.0 112.109 169.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.25 -25.13 68.18 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.526 1.53 . . . . 0.0 114.496 177.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -53.17 -33.11 51.16 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 119.888 1.222 . . . . 0.0 113.734 173.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.47 -38.81 65.31 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.296 1.038 . . . . 0.0 112.955 169.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -97.49 19.44 13.36 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.02 1.328 . . . . 0.0 113.096 -175.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.06 -19.83 63.33 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.323 -1.486 . . . . 0.0 114.395 -176.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.28 8.02 21.3 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 126.322 1.849 . . . . 0.0 113.002 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.5 mptt -75.8 178.97 5.76 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 120.638 -1.289 . . . . 0.0 111.658 176.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.09 171.27 7.47 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.441 1.897 . . . . 0.0 111.011 176.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -45.97 -59.08 5.19 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.825 1.65 . . . . 0.0 112.785 174.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.42 -38.57 19.46 Favored 'Trans proline' 0 C--N 1.357 1.016 0 C-N-CA 122.312 2.008 . . . . 0.0 112.613 178.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.26 -41.87 97.66 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.121 -0.987 . . . . 0.0 112.117 -177.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 12.1 mt -69.43 -51.45 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.103 0.961 . . . . 0.0 110.213 171.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -51.0 -38.08 49.03 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.05 0.841 . . . . 0.0 112.502 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.01 -60.3 3.64 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.383 1.473 . . . . 0.0 111.643 -179.081 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -64.08 -37.4 87.3 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.216 0.606 . . . . 0.0 112.19 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.719 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.1 mm? -64.68 -50.61 66.36 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.641 0.776 . . . . 0.0 110.93 174.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -56.85 -37.97 72.04 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 118.949 0.795 . . . . 0.0 113.014 176.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.07 -50.8 65.95 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -178.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.719 ' HE1' HD13 ' A' ' 40' ' ' LEU . 9.4 p-90 -73.53 -36.38 65.69 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 170.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.419 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.7 OUTLIER -56.89 -32.88 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.086 1.354 . . . . 0.0 112.118 175.977 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -59.73 -16.39 26.99 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.663 0.785 . . . . 0.0 112.538 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.8 m -102.01 -15.9 16.64 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.172 1.389 . . . . 0.0 112.607 177.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.638 HD11 ' CH2' ' A' ' 43' ' ' TRP . 15.2 mt . . . . . 0 N--CA 1.473 0.703 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 177.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.4 -52.36 58.6 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.572 1.549 . . . . 0.0 113.141 176.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -55.07 -34.83 63.94 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 118.585 -0.722 . . . . 0.0 112.143 173.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.27 -51.61 29.2 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.067 0.849 . . . . 0.0 111.778 178.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -58.62 -49.32 77.91 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.899 0.879 . . . . 0.0 111.469 176.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -64.3 -50.03 69.45 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.609 1.163 . . . . 0.0 112.2 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.03 -44.48 91.75 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.177 0.898 . . . . 0.0 111.87 176.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -65.07 -50.42 66.23 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.465 0.706 . . . . 0.0 111.882 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -53.72 -51.2 64.06 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.438 1.095 . . . . 0.0 110.557 172.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.05 -41.04 95.84 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.802 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.86 -50.65 72.96 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.338 1.055 . . . . 0.0 111.999 176.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.42 -47.76 84.28 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.754 0.822 . . . . 0.0 112.635 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -59.68 -51.14 71.06 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.944 0.897 . . . . 0.0 110.687 177.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -46.71 68.14 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.401 1.88 . . . . 0.0 112.968 174.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -54.79 -52.57 62.21 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.187 0.995 . . . . 0.0 112.388 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.99 -30.45 69.71 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 177.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 73.8 t -72.97 -22.57 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.808 1.643 . . . . 0.0 113.153 176.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.65 -30.53 63.44 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 176.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -87.53 0.17 55.96 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.295 1.438 . . . . 0.0 114.554 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.9 tpp -97.09 -162.12 0.93 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.193 1.797 . . . . 0.0 111.844 -177.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -53.41 154.85 5.7 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 126.768 2.027 . . . . 0.0 113.546 171.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -70.13 -43.99 2.06 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.389 2.726 . . . . 0.0 112.41 -177.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -62.45 -28.09 69.57 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.018 0.927 . . . . 0.0 113.26 176.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.33 -48.61 79.05 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.877 -0.514 . . . . 0.0 110.981 177.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.34 -41.26 60.45 Favored 'General case' 0 N--CA 1.482 1.158 0 O-C-N 121.492 -0.755 . . . . 0.0 111.678 173.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.413 ' HB3' ' HB1' ' A' ' 106' ' ' ALA . 66.0 mmtt -61.75 -50.32 72.87 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.484 1.514 . . . . 0.0 111.433 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.93 -46.09 89.43 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-O 121.938 0.875 . . . . 0.0 113.079 177.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -65.75 -41.12 92.5 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 120.729 -1.232 . . . . 0.0 112.369 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.62 -38.89 89.28 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 117.826 -1.083 . . . . 0.0 112.277 171.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.61 ' HB2' HD13 ' A' ' 103' ' ' ILE . 6.6 tm-20 -55.24 -53.36 56.99 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.355 1.434 . . . . 0.0 111.593 170.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.14 -36.2 83.26 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-O 121.159 0.504 . . . . 0.0 112.061 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.5 t -73.49 -40.64 63.94 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.188 -0.945 . . . . 0.0 112.403 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.68 -49.48 58.65 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 117.901 -1.047 . . . . 0.0 109.433 174.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.1 tp -66.48 -29.66 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 119.873 1.215 . . . . 0.0 113.241 -175.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.15 -17.11 62.56 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 173.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 CA--C 1.545 0.771 0 C-N-CA 125.852 1.661 . . . . 0.0 113.146 -178.26 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.61 HD13 ' HB2' ' A' ' 90' ' ' GLU . 1.8 tp . . . . . 0 N--CA 1.471 0.594 0 CA-C-O 118.678 -0.677 . . . . 0.0 112.184 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -43.48 -45.9 6.63 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -55.96 -59.4 4.96 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.876 1.27 . . . . 0.0 111.237 171.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.413 ' HB1' ' HB3' ' A' ' 86' ' ' LYS . . . -57.09 -38.28 73.11 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.177 0.991 . . . . 0.0 113.411 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.33 -49.16 78.71 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 126.327 1.851 . . . . 0.0 111.031 174.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.5 mttm -54.69 -48.2 72.72 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.046 -0.978 . . . . 0.0 111.6 173.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.6 mm -56.67 -48.66 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 CA-C-N 119.026 0.83 . . . . 0.0 111.462 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -58.73 -47.52 84.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.188 0.449 . . . . 0.0 111.579 177.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.81 -49.03 79.11 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.153 1.381 . . . . 0.0 112.075 -176.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.8 pt -68.81 -29.56 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 121.385 -0.822 . . . . 0.0 111.909 173.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.5 t80 . . . . . 0 CA--C 1.541 0.61 0 CA-C-N 119.529 1.059 . . . . 0.0 113.495 176.507 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo . . . . . 0 N--CA 1.459 -0.531 0 CA-C-O 121.704 0.627 . . . . 0.0 111.737 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 29.2 tp60 -63.58 -23.7 67.5 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.367 -0.833 . . . . 0.0 112.219 177.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.1 t -61.86 -51.52 67.88 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.2 1.4 . . . . 0.0 112.184 178.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.9 p -69.06 -37.02 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 O-C-N 121.72 -0.612 . . . . 0.0 111.561 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -60.22 -47.89 84.07 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.917 173.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -68.3 -39.66 81.98 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.458 1.027 . . . . 0.0 112.928 177.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.61 -37.09 82.03 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.097 -1.002 . . . . 0.0 112.246 177.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.89 -20.13 29.51 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.309 1.044 . . . . 0.0 113.571 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.919 0 C-N-CA 126.001 1.72 . . . . 0.0 112.574 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo . . . . . 0 CA--C 1.544 0.998 0 CA-C-O 119.083 -0.465 . . . . 0.0 111.419 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -71.95 -20.47 25.6 Favored 'Trans proline' 0 CA--C 1.55 1.28 0 CA-C-O 115.652 -1.895 . . . . 0.0 116.121 167.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.36 166.5 29.1 Favored 'Trans proline' 0 C--N 1.363 1.303 0 CA-C-N 124.427 2.617 . . . . 0.0 112.219 176.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -59.16 132.37 46.58 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.859 2.372 . . . . 0.0 111.361 169.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -49.82 -46.47 51.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.273 0.629 . . . . 0.0 110.848 169.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.727 ' H ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -93.4 35.44 1.1 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.93 2.492 . . . . 0.0 113.785 -179.606 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.12 110.75 0.19 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.497 1.519 . . . . 0.0 113.864 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.46 18.08 0.28 Allowed Glycine 0 CA--C 1.539 1.588 0 C-N-CA 125.453 1.501 . . . . 0.0 115.717 -174.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.4 160.84 38.09 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 125.857 1.663 . . . . 0.0 112.667 -170.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.09 170.35 20.58 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.504 2.803 . . . . 0.0 113.298 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -53.75 -35.24 61.02 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -179.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.49 -40.53 65.44 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.325 1.45 . . . . 0.0 112.692 173.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.5 t -81.45 -45.27 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 C-N-CA 125.398 1.479 . . . . 0.0 112.203 174.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 92.8 t -54.64 -38.6 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 123.573 0.749 . . . . 0.0 111.07 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -63.35 -50.6 69.35 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.202 -0.936 . . . . 0.0 112.084 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.41 -48.65 71.37 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.018 0.827 . . . . 0.0 112.356 176.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.11 -53.69 39.47 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.719 1.208 . . . . 0.0 111.597 171.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -62.96 -47.52 82.82 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -59.33 -41.36 88.96 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.583 1.153 . . . . 0.0 110.888 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 tp -60.91 -52.01 66.84 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 122.575 0.35 . . . . 0.0 111.306 169.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.45 -33.78 68.3 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 178.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -55.14 -35.16 64.43 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 120.449 1.477 . . . . 0.0 113.319 177.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -72.81 -25.26 61.08 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.993 1.317 . . . . 0.0 113.277 172.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -109.83 14.11 23.31 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 126.216 1.806 . . . . 0.0 113.488 -174.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -21.05 60.18 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.289 -1.507 . . . . 0.0 113.814 -171.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.6 p -109.22 2.47 20.95 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.474 2.31 . . . . 0.0 114.316 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -76.56 170.81 15.72 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.064 1.745 . . . . 0.0 111.906 176.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.404 HG22 ' H ' ' A' ' 33' ' ' ASP . 0.2 OUTLIER -84.51 172.02 12.02 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.768 1.227 . . . . 0.0 112.307 173.7 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.404 ' H ' HG22 ' A' ' 32' ' ' THR . 21.6 t0 -49.45 -63.5 1.66 Allowed Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 127.294 2.238 . . . . 0.0 112.302 173.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -62.21 -32.47 82.57 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 122.755 2.303 . . . . 0.0 113.328 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -64.65 -51.16 64.04 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.679 0.792 . . . . 0.0 111.885 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 50.8 mt -64.74 -52.52 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 124.291 1.036 . . . . 0.0 110.028 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -47.7 -52.05 19.69 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.25 1.82 . . . . 0.0 112.706 178.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -57.71 -44.29 85.8 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.306 0.957 . . . . 0.0 112.702 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.67 -43.29 97.13 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.191 0.997 . . . . 0.0 112.67 174.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.74 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.7 mm? -58.72 -48.98 79.28 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.19 1.396 . . . . 0.0 111.75 173.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -62.95 -37.66 87.96 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 177.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.3 -48.87 73.47 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.74 ' HE1' HD13 ' A' ' 40' ' ' LEU . 7.2 p-90 -73.88 -34.0 64.26 Favored 'General case' 0 CA--C 1.553 1.078 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 173.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.46 HG23 HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -57.82 -32.46 43.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 124.724 1.21 . . . . 0.0 112.485 173.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.39 -15.78 29.4 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 118.677 0.671 . . . . 0.0 112.733 177.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 42.2 m -94.57 -21.44 18.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.947 1.299 . . . . 0.0 113.057 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.577 HD11 ' CH2' ' A' ' 43' ' ' TRP . 24.9 mt . . . . . 0 N--CA 1.477 0.905 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 . . . . . 0 N--CA 1.471 0.613 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 13.2 mmt -73.84 -45.14 52.98 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.97 -35.24 70.91 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.373 0.533 . . . . 0.0 112.011 173.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.65 -50.59 35.12 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.754 1.222 . . . . 0.0 111.263 176.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.8 tptt -55.74 -53.26 58.8 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.783 0.719 . . . . 0.0 110.351 177.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -60.04 -51.73 68.41 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.923 1.289 . . . . 0.0 111.991 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.16 -45.8 93.15 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.599 1.09 . . . . 0.0 113.081 177.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -65.64 -46.65 78.42 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.731 0.813 . . . . 0.0 111.721 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 48.7 mt -57.69 -51.13 70.8 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.365 1.066 . . . . 0.0 111.014 172.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.52 88.62 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.705 0.802 . . . . 0.0 112.142 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -59.43 -50.92 72.08 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.329 1.052 . . . . 0.0 112.277 176.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.91 -47.88 84.37 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.835 0.854 . . . . 0.0 112.775 176.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -55.98 -54.21 47.61 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.844 0.858 . . . . 0.0 111.367 173.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.35 -42.27 77.49 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 119.75 1.159 . . . . 0.0 112.781 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -52.49 64.23 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.416 1.086 . . . . 0.0 112.559 171.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.91 -30.72 70.95 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 176.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 52.9 t -73.09 -25.06 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 126.407 1.883 . . . . 0.0 113.003 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.91 -30.86 66.24 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 177.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.7 pttt -86.68 0.2 55.04 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.168 1.387 . . . . 0.0 114.277 173.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.7 ttm -102.3 -160.3 0.78 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.67 1.988 . . . . 0.0 111.822 -173.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.18 156.12 22.47 Favored Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 125.391 1.476 . . . . 0.0 113.757 177.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.06 -46.19 1.62 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.415 2.743 . . . . 0.0 112.858 -176.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.71 -32.22 70.32 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.153 0.981 . . . . 0.0 112.463 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.72 -49.0 72.56 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.231 0.613 . . . . 0.0 109.96 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -54.33 -43.47 71.25 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 118.564 -0.731 . . . . 0.0 111.464 173.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -59.25 -54.71 43.76 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.255 0.934 . . . . 0.0 110.871 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.77 -49.01 79.24 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 177.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -70.37 -35.79 73.74 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.93 -44.71 88.6 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.906 1.23 . . . . 0.0 111.24 172.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -44.66 82.55 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.824 0.85 . . . . 0.0 111.883 172.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.73 -36.49 83.75 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 121.504 -0.748 . . . . 0.0 112.721 173.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.1 t -72.22 -37.63 69.16 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.786 -1.196 . . . . 0.0 112.644 -177.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -71.08 -51.4 25.4 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 118.911 -0.566 . . . . 0.0 110.032 173.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.5 tt -63.41 -29.77 48.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-N 119.111 0.869 . . . . 0.0 112.881 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.43 -24.2 63.3 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 177.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 . . . . . 0 N--CA 1.475 0.785 0 C-N-CA 124.473 1.109 . . . . 0.0 113.758 170.912 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.473 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -47.49 -36.7 10.58 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.56 1.144 . . . . 0.0 113.283 171.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.9 mttt -60.47 -59.42 5.43 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.028 0.831 . . . . 0.0 111.238 173.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.473 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.55 -37.44 87.55 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.036 0.835 . . . . 0.0 111.942 -175.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.6 tm0? -53.27 -51.66 61.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.2 1.0 . . . . 0.0 110.892 171.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -59.51 -49.22 78.62 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 118.05 -0.976 . . . . 0.0 112.57 176.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 33.9 mm -50.74 -48.57 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.64 1.176 . . . . 0.0 110.947 174.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -66.8 -43.26 84.32 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 121.286 -0.884 . . . . 0.0 112.194 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.51 -42.52 92.43 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.524 1.129 . . . . 0.0 112.636 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.7 pp -74.86 -40.12 45.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 121.685 -0.634 . . . . 0.0 111.861 172.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 67.2 t80 . . . . . 0 N--CA 1.474 0.729 0 C-N-CA 124.731 1.213 . . . . 0.0 113.427 179.873 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 CA--C 1.535 0.548 0 CA-C-O 121.679 0.616 . . . . 0.0 112.584 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -59.22 -22.09 60.52 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 11.2 t -64.17 -51.7 62.56 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.538 1.063 . . . . 0.0 111.793 174.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.9 p -73.88 -38.01 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 O-C-N 121.7 -0.625 . . . . 0.0 111.502 178.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 mmmt -58.11 -49.5 76.73 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 118.521 -0.752 . . . . 0.0 111.896 172.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -68.2 -39.3 82.48 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.701 1.137 . . . . 0.0 113.388 178.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -67.23 -34.72 78.06 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.474 1.034 . . . . 0.0 112.641 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.51 -21.4 26.98 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.095 0.958 . . . . 0.0 113.148 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 C-N-CA 125.392 1.477 . . . . 0.0 113.909 177.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo . . . . . 0 CA--C 1.544 0.998 0 CA-C-O 119.189 -0.421 . . . . 0.0 111.491 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -70.32 -22.53 29.39 Favored 'Trans proline' 0 CA--C 1.552 1.402 0 CA-C-O 115.727 -1.864 . . . . 0.0 115.817 163.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.93 169.32 19.4 Favored 'Trans proline' 0 C--N 1.363 1.309 0 CA-C-N 124.222 2.544 . . . . 0.0 112.484 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -59.86 129.3 29.95 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.398 2.065 . . . . 0.0 110.357 171.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -47.67 -47.86 29.29 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.141 0.576 . . . . 0.0 110.964 170.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.755 ' H ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -91.56 38.77 0.99 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 128.997 2.919 . . . . 0.0 114.242 177.293 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.5 112.69 0.41 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.511 1.125 . . . . 0.0 113.609 174.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 143.65 -12.86 2.21 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.958 1.742 . . . . 0.0 114.616 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.31 161.29 75.45 Favored Pre-proline 0 CA--C 1.558 1.281 0 C-N-CA 125.342 1.457 . . . . 0.0 113.706 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -75.7 172.72 15.77 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.913 3.075 . . . . 0.0 113.675 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -53.31 -37.76 62.56 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.851 1.261 . . . . 0.0 113.821 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -53.24 -41.14 65.14 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.024 1.33 . . . . 0.0 112.696 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.6 t -80.47 -42.23 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 124.599 1.16 . . . . 0.0 111.983 174.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -54.81 -39.31 47.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-N 118.593 0.633 . . . . 0.0 110.688 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.3 tptm -61.16 -50.65 72.29 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.079 -1.013 . . . . 0.0 112.137 174.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.6 -50.4 68.15 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.177 0.591 . . . . 0.0 111.816 176.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.44 -50.58 59.47 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.807 0.843 . . . . 0.0 111.9 170.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.15 -47.45 85.86 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.285 0.948 . . . . 0.0 112.819 -176.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -70.96 -32.28 69.1 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.949 -0.47 . . . . 0.0 111.899 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.3 tp -64.35 -49.15 72.81 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.775 0.83 . . . . 0.0 111.516 170.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -66.53 -29.51 69.62 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.926 1.29 . . . . 0.0 114.448 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.6 mttm -54.7 -51.84 64.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 120.062 1.301 . . . . 0.0 112.833 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.95 -17.93 64.59 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.561 1.144 . . . . 0.0 113.687 173.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -108.79 18.65 20.55 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.543 1.937 . . . . 0.0 113.693 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.09 -20.46 65.98 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 120.18 -1.575 . . . . 0.0 113.512 -176.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -103.51 6.76 37.65 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 126.859 2.064 . . . . 0.0 112.991 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -73.73 -172.55 1.28 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.503 1.521 . . . . 0.0 112.704 173.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 m -123.48 170.44 10.38 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 128.098 2.559 . . . . 0.0 110.453 -178.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.7 -56.78 7.89 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.849 1.659 . . . . 0.0 112.637 175.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -68.82 -41.99 5.03 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.212 1.941 . . . . 0.0 113.072 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.53 -41.56 94.68 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.379 -1.451 . . . . 0.0 112.654 -178.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 64.3 mt -69.46 -53.43 24.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 123.588 0.755 . . . . 0.0 109.641 174.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -58.63 -35.39 72.42 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.037 0.835 . . . . 0.0 111.662 -174.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -54.31 -60.9 2.72 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.337 1.455 . . . . 0.0 112.579 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.6 -36.88 85.26 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.074 0.549 . . . . 0.0 112.078 -178.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.594 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.4 mm? -63.06 -48.97 76.39 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.437 1.095 . . . . 0.0 111.574 174.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -65.23 -34.13 77.63 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 121.568 -0.708 . . . . 0.0 112.363 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.22 -50.87 66.12 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.454 -0.779 . . . . 0.0 112.574 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.594 ' HE1' HD13 ' A' ' 40' ' ' LEU . 7.8 p-90 -73.88 -31.33 63.08 Favored 'General case' 0 CA--C 1.557 1.249 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 170.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.499 HG23 HD12 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -59.46 -32.48 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 O-C-N 120.243 -1.536 . . . . 0.0 111.813 174.136 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -59.2 -18.62 38.23 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.583 -0.698 . . . . 0.0 112.366 176.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -97.61 -13.59 21.48 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.861 1.264 . . . . 0.0 113.237 177.005 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.549 HD11 ' CH2' ' A' ' 43' ' ' TRP . 22.0 mt . . . . . 0 N--CA 1.474 0.771 0 CA-C-N 119.048 0.84 . . . . 0.0 112.667 174.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.02 -48.53 73.58 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.383 1.073 . . . . 0.0 112.075 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -54.73 -39.99 68.8 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.517 0.727 . . . . 0.0 111.556 172.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.25 -51.17 56.34 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.798 0.726 . . . . 0.0 111.454 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -60.35 -48.16 82.96 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.73 0.812 . . . . 0.0 111.027 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -61.24 -49.83 75.53 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.067 1.347 . . . . 0.0 112.089 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.82 -51.63 68.22 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.788 1.176 . . . . 0.0 112.86 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -62.78 -48.36 79.49 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.811 -0.556 . . . . 0.0 112.465 178.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.1 tp -54.46 -51.24 65.63 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.184 0.994 . . . . 0.0 110.955 174.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.78 -42.92 99.61 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.581 1.152 . . . . 0.0 112.072 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -58.17 -50.84 72.11 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.824 1.193 . . . . 0.0 111.466 174.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.34 -47.86 80.42 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.762 0.825 . . . . 0.0 112.713 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -54.5 -56.29 20.37 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.209 1.004 . . . . 0.0 111.068 172.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.82 -40.81 73.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.519 1.128 . . . . 0.0 113.205 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.51 -52.54 65.2 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 171.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.19 -29.76 70.09 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 176.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.6 t -73.13 -26.66 23.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 125.868 1.667 . . . . 0.0 112.678 175.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.56 -34.32 64.64 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.5 pttt -85.03 1.71 46.46 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.286 1.435 . . . . 0.0 114.347 175.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.7 ttm -103.25 -159.27 0.71 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.985 2.114 . . . . 0.0 111.695 -174.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.74 156.71 11.81 Favored Pre-proline 0 N--CA 1.479 1.003 0 C-N-CA 125.283 1.433 . . . . 0.0 113.864 176.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.43 -45.54 1.73 Allowed 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.448 2.765 . . . . 0.0 112.803 -177.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -61.3 -30.71 70.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.147 0.979 . . . . 0.0 112.438 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.76 -48.44 71.82 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.837 0.455 . . . . 0.0 110.23 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.19 -44.62 68.07 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.385 173.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm -59.53 -54.77 42.68 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.034 0.833 . . . . 0.0 110.863 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.08 -49.14 78.81 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.698 -0.626 . . . . 0.0 112.481 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -66.55 -32.94 74.61 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.05 -46.57 80.68 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.663 1.119 . . . . 0.0 111.577 172.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -56.91 -47.06 81.45 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 118.891 0.769 . . . . 0.0 111.662 172.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.6 tp -63.06 -38.75 92.44 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 176.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 21.7 t -71.13 -42.97 68.52 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.69 -1.256 . . . . 0.0 112.256 -178.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.38 -46.11 70.92 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 118.666 -0.683 . . . . 0.0 110.624 175.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.3 tp -66.47 -33.72 65.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 119.263 0.938 . . . . 0.0 111.717 -178.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.04 -32.77 74.45 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 . . . . . 0 N--CA 1.471 0.577 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 173.234 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.411 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -46.93 -37.72 9.41 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.873 1.269 . . . . 0.0 113.429 -178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -61.1 -59.42 5.37 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.864 0.866 . . . . 0.0 110.947 172.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.411 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -63.81 -33.63 76.1 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.794 0.724 . . . . 0.0 112.285 -177.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.07 -50.99 71.96 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.83 1.252 . . . . 0.0 111.426 173.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.9 -48.47 79.79 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.111 0.964 . . . . 0.0 111.03 173.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 18.4 mm -53.31 -50.59 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 124.378 1.071 . . . . 0.0 111.322 176.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -63.13 -44.44 95.56 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.779 1.172 . . . . 0.0 112.887 176.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.81 -49.0 78.1 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.077 0.951 . . . . 0.0 110.784 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.4 pt -70.49 -38.86 75.2 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 CA-C-O 118.243 -0.884 . . . . 0.0 112.629 173.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 81.6 t80 . . . . . 0 N--CA 1.475 0.783 0 CA-C-N 121.006 1.73 . . . . 0.0 113.075 -178.62 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo . . . . . 0 CA--C 1.537 0.63 0 CA-C-O 121.743 0.643 . . . . 0.0 111.904 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -60.53 -27.33 67.54 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.401 -0.812 . . . . 0.0 113.036 173.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 65.6 m -60.46 -51.71 68.32 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.435 1.471 . . . . 0.0 112.381 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.461 HG22 HD23 ' A' ' 124' ' ' LEU . 14.8 p -68.56 -40.15 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.811 -0.556 . . . . 0.0 111.638 175.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 mmtt -58.16 -48.1 81.33 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.502 174.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -69.05 -38.17 78.95 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.674 1.125 . . . . 0.0 113.444 177.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -69.29 -37.09 77.66 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.605 1.093 . . . . 0.0 112.326 177.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.461 HD23 HG22 ' A' ' 120' ' ' VAL . 0.5 OUTLIER -85.83 -20.82 28.57 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.682 1.193 . . . . 0.0 113.132 179.413 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.11 0 C-N-CA 126.605 1.962 . . . . 0.0 113.601 177.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo . . . . . 0 CA--C 1.546 1.081 0 N-CA-C 111.079 -0.393 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -69.47 -22.8 32.89 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 CA-C-O 115.381 -2.008 . . . . 0.0 115.995 164.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.89 169.9 20.13 Favored 'Trans proline' 0 C--N 1.363 1.333 0 CA-C-N 124.487 2.638 . . . . 0.0 113.451 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -62.21 121.24 9.17 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.18 2.586 . . . . 0.0 111.975 175.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -56.72 -19.14 15.17 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 171.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.401 ' N ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -117.29 36.69 4.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 129.317 3.047 . . . . 0.0 112.415 178.128 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.16 110.89 0.24 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.401 1.48 . . . . 0.0 113.007 175.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.17 13.11 0.2 Allowed Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.916 1.246 . . . . 0.0 115.766 -174.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -116.76 160.02 38.28 Favored Pre-proline 0 CA--C 1.554 1.114 0 C-N-CA 125.663 1.585 . . . . 0.0 112.67 -170.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -73.82 171.4 17.94 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.423 2.749 . . . . 0.0 113.299 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -55.35 -34.01 63.9 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -53.3 -40.71 64.96 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.249 1.42 . . . . 0.0 112.779 171.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 56.0 t -78.75 -44.18 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 124.508 1.123 . . . . 0.0 111.986 173.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 73.7 t -53.91 -39.52 40.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-N 118.816 0.735 . . . . 0.0 111.211 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 tptm -62.78 -50.45 70.99 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.038 -1.038 . . . . 0.0 112.223 174.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.63 -49.24 71.0 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.258 0.623 . . . . 0.0 111.691 176.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.89 -51.19 58.56 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.29 1.036 . . . . 0.0 111.976 170.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.44 -47.3 86.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.881 1.218 . . . . 0.0 113.312 -177.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -65.7 -40.41 92.25 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.895 -0.503 . . . . 0.0 110.979 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.2 tp -61.66 -46.38 89.99 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.862 0.865 . . . . 0.0 111.524 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -63.16 -40.8 98.58 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.714 -1.241 . . . . 0.0 113.8 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.5 mmtp -56.06 -36.0 67.56 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 119.262 0.937 . . . . 0.0 112.974 174.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.68 -38.35 70.64 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.274 1.43 . . . . 0.0 113.497 173.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -98.3 20.39 12.65 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.538 1.535 . . . . 0.0 113.168 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -66.67 -17.08 64.66 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 119.813 -1.804 . . . . 0.0 113.923 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.0 p -95.35 2.01 54.51 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 127.312 2.245 . . . . 0.0 114.363 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -84.08 179.42 7.51 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.652 1.581 . . . . 0.0 111.163 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.44 170.8 7.73 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.673 1.989 . . . . 0.0 111.068 177.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -47.78 -58.35 7.89 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 124.987 1.315 . . . . 0.0 112.221 175.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.75 -36.85 17.57 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.044 1.829 . . . . 0.0 114.26 178.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.99 -45.08 96.25 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 120.959 -1.088 . . . . 0.0 111.918 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.8 mt -69.46 -48.53 66.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-O 118.665 -0.683 . . . . 0.0 110.552 175.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -52.31 -41.11 62.68 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.244 0.929 . . . . 0.0 111.249 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.64 -50.75 71.3 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.215 1.406 . . . . 0.0 112.63 177.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.09 -43.31 95.62 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.45 0.7 . . . . 0.0 112.278 176.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.705 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.3 mm? -63.26 -48.54 77.74 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.727 0.811 . . . . 0.0 110.525 175.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -60.41 -31.27 70.22 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 176.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.16 -51.75 68.67 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.437 -0.789 . . . . 0.0 112.072 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.705 ' HE1' HD13 ' A' ' 40' ' ' LEU . 15.8 p-90 -73.84 -31.22 63.1 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 112.986 0.735 . . . . 0.0 112.986 173.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.422 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -57.82 -32.89 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 125.6 1.56 . . . . 0.0 112.993 174.45 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -57.77 -15.75 9.1 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.24 -14.84 18.3 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.469 1.507 . . . . 0.0 113.549 176.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.661 HD11 ' CH2' ' A' ' 43' ' ' TRP . 23.4 mt . . . . . 0 N--CA 1.475 0.807 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 176.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -61.47 -53.39 57.04 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 121.522 -0.736 . . . . 0.0 112.437 177.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.8 mmtm -55.74 -35.55 66.29 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.2 1.0 . . . . 0.0 111.817 176.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.12 -51.02 42.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.071 0.948 . . . . 0.0 111.034 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.69 -46.4 89.19 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.694 0.798 . . . . 0.0 111.55 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -62.72 -51.71 66.13 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.675 1.19 . . . . 0.0 112.019 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.11 -46.03 86.23 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.039 0.836 . . . . 0.0 112.432 177.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -63.42 -46.67 85.26 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.038 0.935 . . . . 0.0 112.46 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -56.44 -50.97 70.12 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.223 1.009 . . . . 0.0 111.325 171.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.12 -40.47 89.82 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.248 0.619 . . . . 0.0 111.986 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -61.45 -50.23 73.6 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.764 1.226 . . . . 0.0 111.668 175.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.68 -47.05 85.81 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.542 0.61 . . . . 0.0 112.332 177.055 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.433 ' O ' HG23 ' A' ' 77' ' ' VAL . 0.7 OUTLIER -57.24 -53.56 56.71 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.922 0.889 . . . . 0.0 111.26 175.185 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -50.82 -45.69 59.63 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.3 1.44 . . . . 0.0 113.155 174.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.3 -50.87 72.09 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.944 1.298 . . . . 0.0 111.973 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.38 -34.14 77.6 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 172.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 73' ' ' HIS . 72.3 t -72.2 -23.46 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 124.927 1.291 . . . . 0.0 112.578 179.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.03 -31.25 60.95 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.68 -1.263 . . . . 0.0 114.382 175.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.93 -2.79 52.55 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.986 1.314 . . . . 0.0 114.298 176.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.21 -160.27 0.79 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.832 2.053 . . . . 0.0 112.036 -174.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -52.57 155.05 4.08 Favored Pre-proline 0 N--CA 1.479 0.985 0 C-N-CA 126.529 1.932 . . . . 0.0 113.485 171.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -67.05 -49.96 1.21 Allowed 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.296 2.664 . . . . 0.0 112.269 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -61.08 -27.76 68.59 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.967 1.307 . . . . 0.0 113.298 178.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.85 -51.96 62.24 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.913 0.485 . . . . 0.0 110.086 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.2 -42.3 66.15 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.265 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.2 mmtm -60.29 -54.73 42.2 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.564 0.62 . . . . 0.0 110.654 -178.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.38 84.04 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.424 0.689 . . . . 0.0 112.788 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.14 -40.51 86.76 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 177.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.96 -48.35 82.05 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.378 1.071 . . . . 0.0 111.074 171.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.63 -43.76 72.55 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.364 1.066 . . . . 0.0 112.057 173.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.455 ' HA ' HG22 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -68.79 -34.59 75.8 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 118.893 0.77 . . . . 0.0 112.866 176.332 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.9 t -71.96 -43.73 64.72 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.754 -1.216 . . . . 0.0 113.016 177.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -35.5 68.91 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.316 1.046 . . . . 0.0 111.705 176.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.455 HG22 ' HA ' ' A' ' 91' ' ' LEU . 5.6 tt -73.05 -32.73 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 119.253 0.933 . . . . 0.0 111.906 175.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.36 -16.66 37.27 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.546 0.797 0 C-N-CA 125.713 1.605 . . . . 0.0 113.566 175.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.478 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -47.63 -33.87 7.25 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.297 1.439 . . . . 0.0 113.272 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -59.38 -59.57 5.24 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.797 0.839 . . . . 0.0 111.053 171.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.478 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.09 -37.83 88.87 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.19 0.905 . . . . 0.0 111.849 -176.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -53.92 -52.02 61.9 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.67 0.788 . . . . 0.0 111.17 172.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.6 tttt -58.17 -51.78 68.31 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.683 175.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 25.5 mm -49.78 -46.92 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.438 1.095 . . . . 0.0 110.584 178.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -69.16 -42.54 75.78 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.635 0.774 . . . . 0.0 112.795 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.45 -31.99 71.96 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.229 1.412 . . . . 0.0 113.672 174.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 29.3 pt -87.32 -31.31 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 119.113 0.869 . . . . 0.0 112.596 171.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.413 ' OH ' HD11 ' A' ' 124' ' ' LEU . 66.2 t80 . . . . . 0 N--CA 1.466 0.335 0 O-C-N 120.843 -1.16 . . . . 0.0 111.911 176.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 CA--C 1.536 0.589 0 CA-C-O 121.545 0.56 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -60.35 -24.34 64.99 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 174.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.3 p -63.93 -51.32 64.96 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.691 1.132 . . . . 0.0 112.019 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.4 p -71.88 -39.31 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.853 -0.529 . . . . 0.0 111.576 176.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -56.71 -51.62 68.1 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 118.607 -0.711 . . . . 0.0 112.001 172.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -67.79 -42.38 81.74 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.578 1.081 . . . . 0.0 112.247 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.83 -35.85 81.28 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.115 -0.991 . . . . 0.0 112.546 176.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.413 HD11 ' OH ' ' A' ' 113' ' ' TYR . 0.5 OUTLIER -90.18 -19.41 24.25 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.113 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 . . . . . 0 N--CA 1.48 1.025 0 C-N-CA 126.106 1.762 . . . . 0.0 113.065 176.378 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo . . . . . 0 CA--C 1.544 0.984 0 CA-C-O 119.257 -0.393 . . . . 0.0 111.849 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.14 -21.66 26.93 Favored 'Trans proline' 0 CA--C 1.553 1.467 0 C-N-CA 122.591 2.194 . . . . 0.0 116.654 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.4 167.41 25.36 Favored 'Trans proline' 0 C--N 1.361 1.216 0 CA-C-N 124.241 2.55 . . . . 0.0 112.271 176.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.443 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 33.3 Cg_endo -58.27 133.33 54.43 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.803 2.335 . . . . 0.0 111.752 170.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -49.24 -48.68 45.47 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.397 0.679 . . . . 0.0 111.635 171.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.556 HD23 ' H ' ' A' ' 10' ' ' LEU . 1.6 pt? -81.34 18.1 1.2 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 127.128 2.171 . . . . 0.0 115.03 -178.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.36 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.956 2.102 . . . . 0.0 115.467 -172.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.19 24.22 0.1 Allowed Glycine 0 CA--C 1.538 1.502 0 C-N-CA 124.979 1.276 . . . . 0.0 114.758 -173.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -121.76 157.74 56.31 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 125.856 1.662 . . . . 0.0 111.944 -173.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -73.99 169.14 23.11 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.182 2.588 . . . . 0.0 113.205 -177.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -52.09 -41.06 62.1 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.585 1.554 . . . . 0.0 113.275 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -54.22 -42.01 69.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.09 1.356 . . . . 0.0 112.91 173.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.5 t -78.9 -39.24 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.371 1.069 . . . . 0.0 111.503 176.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 46.9 t -57.04 -40.08 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.689 0.795 . . . . 0.0 111.098 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.9 tptt -63.02 -50.63 69.94 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.9 -1.125 . . . . 0.0 111.968 174.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -52.84 -48.42 67.02 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.501 0.72 . . . . 0.0 112.232 174.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.443 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 1.5 t80 -50.66 -53.66 29.24 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.593 1.157 . . . . 0.0 111.964 168.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.35 -47.48 85.86 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -62.11 -42.87 99.67 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.541 0.736 . . . . 0.0 111.166 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.4 tp -58.25 -47.7 82.75 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.522 0.729 . . . . 0.0 111.258 172.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -64.39 -30.75 71.79 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -57.89 -29.97 65.49 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 120.392 1.451 . . . . 0.0 113.279 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -46.34 68.59 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.613 1.165 . . . . 0.0 112.105 169.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -94.16 17.68 12.17 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.336 1.854 . . . . 0.0 114.046 -174.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.76 -25.03 66.2 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 120.044 -1.66 . . . . 0.0 113.316 -172.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.2 p -87.51 -0.48 56.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.555 1.942 . . . . 0.0 114.284 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -81.15 161.1 24.2 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.13 1.372 . . . . 0.0 112.245 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -87.15 171.28 10.8 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.749 2.02 . . . . 0.0 111.651 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -41.91 -59.75 2.39 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 127.487 2.315 . . . . 0.0 113.237 172.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.402 ' HB3' ' HG3' ' A' ' 62' ' ' MET . 83.4 Cg_endo -74.06 -31.34 7.99 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 122.048 1.832 . . . . 0.0 113.578 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.69 -42.84 90.76 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.874 -1.141 . . . . 0.0 111.76 177.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.3 mt -65.97 -53.34 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 123.451 0.7 . . . . 0.0 109.824 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -56.82 -39.16 73.66 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.262 0.937 . . . . 0.0 112.216 -174.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.1 tttm -59.6 -57.41 13.05 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.575 1.15 . . . . 0.0 112.871 177.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -63.18 -38.04 89.6 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.865 -0.522 . . . . 0.0 111.878 -178.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.672 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.0 OUTLIER -63.12 -48.77 77.12 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.62 1.168 . . . . 0.0 111.402 174.27 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.52 -41.19 72.81 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 121.389 -0.819 . . . . 0.0 113.027 173.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.54 -47.56 73.03 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -176.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.675 ' CH2' HD11 ' A' ' 47' ' ' LEU . 7.4 p-90 -73.99 -36.63 64.53 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 114.59 1.329 . . . . 0.0 114.59 168.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.07 -33.37 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 125.363 1.465 . . . . 0.0 112.326 175.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -59.9 -12.42 7.64 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.055 0.942 . . . . 0.0 112.931 177.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.1 m -109.86 -10.7 14.74 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.767 1.627 . . . . 0.0 112.537 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.675 HD11 ' CH2' ' A' ' 43' ' ' TRP . 16.4 mt . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 173.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 . . . . . 0 CA--C 1.543 0.7 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.402 ' HG3' ' HB3' ' A' ' 34' ' ' PRO . 9.8 tmm? -61.79 -51.32 68.75 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 121.514 -0.741 . . . . 0.0 112.542 175.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -63.82 -28.6 69.97 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.62 0.368 . . . . 0.0 111.399 177.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.43 -51.46 14.87 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.56 1.144 . . . . 0.0 111.916 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.48 -52.67 64.64 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.464 0.575 . . . . 0.0 110.139 174.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.38 -49.19 78.13 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.251 -178.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.36 -46.55 88.15 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.867 1.212 . . . . 0.0 113.064 177.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -66.16 -46.86 75.93 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 118.847 0.749 . . . . 0.0 112.435 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 75.7 mt -57.75 -49.38 76.76 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.463 1.105 . . . . 0.0 110.855 173.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.56 -43.93 96.72 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.188 -0.91 . . . . 0.0 112.233 177.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.7 mtpt -56.21 -50.68 70.57 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.458 1.481 . . . . 0.0 112.421 173.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.49 -51.32 67.92 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 177.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -57.09 -51.99 67.09 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.69 0.796 . . . . 0.0 111.715 175.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.08 -44.62 67.67 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.91 1.284 . . . . 0.0 112.113 176.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -57.18 -52.29 65.9 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.642 0.655 . . . . 0.0 112.583 174.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.31 -30.97 70.95 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 178.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.6 t -72.74 -25.37 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 126.79 2.036 . . . . 0.0 112.913 175.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.44 -30.68 63.15 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.178 1.547 . . . . 0.0 115.178 176.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 pttt -88.73 3.15 51.9 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 125.821 1.648 . . . . 0.0 114.181 172.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 9.1 ttm -106.31 -163.55 0.93 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.695 1.998 . . . . 0.0 111.333 -173.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.15 152.93 20.23 Favored Pre-proline 0 N--CA 1.481 1.091 0 C-N-CA 125.702 1.601 . . . . 0.0 114.209 178.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -68.52 -46.51 1.89 Allowed 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.885 3.057 . . . . 0.0 113.303 -173.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.92 -37.19 71.13 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.411 1.484 . . . . 0.0 112.49 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.0 -46.57 80.88 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.329 0.652 . . . . 0.0 109.828 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -45.39 58.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.418 1.087 . . . . 0.0 111.977 174.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -65.85 -51.62 57.34 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.707 1.203 . . . . 0.0 112.069 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.68 -45.2 92.78 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.167 0.987 . . . . 0.0 113.0 177.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.94 -36.93 70.04 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.065 -1.022 . . . . 0.0 113.234 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.79 97.21 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.496 1.044 . . . . 0.0 111.714 171.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -53.97 -50.51 66.37 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.218 1.407 . . . . 0.0 111.625 170.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 9.6 tp -59.53 -39.69 84.72 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 174.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.5 t -72.62 -38.36 67.8 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.189 -0.945 . . . . 0.0 112.684 -175.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -71.26 -48.66 49.67 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.443 0.697 . . . . 0.0 110.833 174.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.7 tt -67.12 -27.71 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.08 -34.48 70.2 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 . . . . . 0 CA--C 1.542 0.661 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 171.011 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -49.47 -35.97 21.28 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.44 1.496 . . . . 0.0 112.975 174.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -57.12 -59.38 5.17 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.595 1.158 . . . . 0.0 111.48 173.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.96 -36.92 85.94 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.582 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.63 -47.25 80.1 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.709 1.204 . . . . 0.0 110.931 174.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.74 -52.41 62.6 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 117.529 -1.224 . . . . 0.0 112.473 168.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 8.9 mm -52.68 -45.23 48.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 CA-C-N 119.705 1.139 . . . . 0.0 111.678 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -67.37 -45.09 77.31 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.043 0.937 . . . . 0.0 112.018 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.84 -47.37 86.65 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.57 1.148 . . . . 0.0 112.132 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -69.05 -38.62 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.879 -0.513 . . . . 0.0 111.986 173.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 71.9 t80 . . . . . 0 N--CA 1.474 0.733 0 CA-C-N 120.181 1.355 . . . . 0.0 112.859 175.8 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo . . . . . 0 CA--C 1.536 0.601 0 CA-C-O 121.875 0.698 . . . . 0.0 113.251 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 68.5 mm-40 -55.43 -27.84 50.5 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.072 0.949 . . . . 0.0 112.722 176.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.24 -51.69 68.7 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.584 1.154 . . . . 0.0 112.707 176.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -70.96 -46.37 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 O-C-N 121.609 -0.682 . . . . 0.0 109.642 175.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -58.48 -40.96 84.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 118.936 -1.106 . . . . 0.0 110.023 -173.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -65.54 -46.59 78.98 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.109 1.363 . . . . 0.0 112.712 173.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -37.24 79.01 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 119.591 1.087 . . . . 0.0 112.796 179.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.2 pp -89.01 -21.53 23.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.491 0.716 . . . . 0.0 112.825 -179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 . . . . . 0 N--CA 1.478 0.974 0 C-N-CA 125.814 1.646 . . . . 0.0 113.839 176.106 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo . . . . . 0 CA--C 1.547 1.133 0 CA-C-O 118.999 -0.5 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -68.53 -21.85 39.33 Favored 'Trans proline' 0 CA--C 1.554 1.499 0 N-CA-C 116.977 1.876 . . . . 0.0 116.977 170.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.89 166.98 27.22 Favored 'Trans proline' 0 C--N 1.362 1.269 0 CA-C-N 124.264 2.559 . . . . 0.0 112.882 176.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.16 148.08 84.63 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.073 2.516 . . . . 0.0 112.543 175.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -61.18 -24.66 66.47 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.492 ' H ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -112.57 32.87 5.31 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.869 2.468 . . . . 0.0 111.629 177.621 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.18 116.55 0.84 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.86 1.264 . . . . 0.0 113.148 171.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.99 -11.53 2.85 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 126.362 1.934 . . . . 0.0 113.629 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.97 158.89 52.57 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.809 1.644 . . . . 0.0 112.453 -178.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.65 174.18 12.67 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.821 2.348 . . . . 0.0 113.609 -178.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -52.09 -35.72 48.68 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.49 1.516 . . . . 0.0 113.094 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -52.9 -41.26 64.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.459 1.503 . . . . 0.0 113.178 172.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 69.7 t -80.75 -41.24 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.488 1.115 . . . . 0.0 111.828 175.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 43.2 t -56.58 -37.82 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.382 0.673 . . . . 0.0 111.299 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.2 tptt -62.12 -50.69 70.88 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.352 -0.842 . . . . 0.0 112.312 172.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.27 -46.8 76.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.523 0.729 . . . . 0.0 111.532 177.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -51.78 -53.8 35.78 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.678 1.191 . . . . 0.0 111.747 168.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.25 -47.45 83.52 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.671 1.123 . . . . 0.0 113.925 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.74 -41.33 96.01 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.155 0.582 . . . . 0.0 111.621 178.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.9 tp -60.16 -44.99 94.58 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.21 0.604 . . . . 0.0 111.42 172.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.636 HD11 HG21 ' A' ' 36' ' ' ILE . 1.5 mm? -61.7 -38.82 89.25 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.513 1.925 . . . . 0.0 114.012 178.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -54.25 -31.1 52.63 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 174.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -68.65 -44.96 73.03 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.193 0.997 . . . . 0.0 112.399 175.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -101.41 26.99 6.62 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.741 2.016 . . . . 0.0 112.606 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -24.95 43.79 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.903 1.281 . . . . 0.0 113.918 -179.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.81 -30.53 64.14 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.297 1.839 . . . . 0.0 113.262 176.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.5 mmtt -65.85 142.86 57.78 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.335 1.054 . . . . 0.0 110.212 176.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.59 158.25 34.38 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.464 0.706 . . . . 0.0 109.465 171.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -37.96 -58.99 1.27 Allowed Pre-proline 0 CA--C 1.552 1.056 0 CA-C-O 117.242 -1.361 . . . . 0.0 113.956 173.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -57.98 -44.25 41.49 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.012 3.141 . . . . 0.0 114.536 177.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -58.97 -39.01 80.42 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.922 0.889 . . . . 0.0 111.755 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.636 HG21 HD11 ' A' ' 25' ' ' LEU . 25.0 mt -66.07 -47.4 85.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 124.026 0.931 . . . . 0.0 110.362 173.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -52.26 -39.01 59.83 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.15 -57.35 9.88 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 122.091 0.948 . . . . 0.0 113.164 170.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -32.49 74.0 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.284 -0.885 . . . . 0.0 112.551 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.725 HD13 ' HE1' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -62.31 -49.97 73.51 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.015 1.326 . . . . 0.0 110.77 170.942 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -54.66 -35.53 63.62 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.893 0.877 . . . . 0.0 113.131 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.36 45.04 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.725 ' HE1' HD13 ' A' ' 40' ' ' LEU . 9.7 p-90 -73.79 -33.83 64.39 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 174.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.422 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -57.74 -31.57 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.401 1.48 . . . . 0.0 111.656 174.663 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -57.8 -17.84 18.32 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.383 0.992 . . . . 0.0 112.82 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.68 -11.32 23.64 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.172 1.389 . . . . 0.0 113.223 176.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.567 HD11 ' CH2' ' A' ' 43' ' ' TRP . 30.5 mt . . . . . 0 N--CA 1.475 0.796 0 CA-C-N 119.079 0.854 . . . . 0.0 112.618 171.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -59.78 -53.41 58.25 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 123.742 0.817 . . . . 0.0 112.451 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.5 mttm -57.36 -34.47 68.84 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.216 1.006 . . . . 0.0 112.195 175.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.01 -51.38 32.77 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.882 0.873 . . . . 0.0 111.747 178.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.34 -52.45 65.3 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.321 1.048 . . . . 0.0 110.388 176.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -61.31 -49.84 75.4 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.202 1.001 . . . . 0.0 111.951 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.61 -48.72 78.65 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.511 1.505 . . . . 0.0 112.753 177.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -62.44 -53.96 47.23 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.184 0.594 . . . . 0.0 111.988 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.5 tp -54.09 -51.27 64.68 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.08 1.352 . . . . 0.0 110.354 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.81 -48.19 82.14 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 124.119 0.968 . . . . 0.0 111.393 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.96 -50.59 68.52 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 120.747 1.612 . . . . 0.0 112.315 176.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.0 -50.89 71.97 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.628 0.771 . . . . 0.0 112.666 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -58.76 -48.96 79.41 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.746 1.219 . . . . 0.0 110.932 178.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -54.38 -44.31 72.17 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.606 1.962 . . . . 0.0 112.539 174.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -59.02 -50.54 73.71 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.472 0.709 . . . . 0.0 112.014 175.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.19 -38.16 90.07 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 121.221 0.534 . . . . 0.0 112.286 175.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.8 t -69.02 -27.56 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 C-N-CA 125.84 1.656 . . . . 0.0 112.868 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.18 -22.04 6.0 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 174.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.2 pttt -116.45 1.52 12.99 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.96 1.704 . . . . 0.0 114.566 174.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 31.9 tpp -86.56 -83.86 0.18 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.754 1.621 . . . . 0.0 111.175 -177.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.7 150.72 76.57 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 127.579 2.351 . . . . 0.0 112.452 -175.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -71.22 -49.7 0.36 Allowed 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 123.899 3.066 . . . . 0.0 113.372 -176.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.4 -37.97 89.4 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.857 1.263 . . . . 0.0 112.2 177.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.69 -36.06 82.61 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.316 0.646 . . . . 0.0 110.774 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.73 -48.32 66.77 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.087 0.955 . . . . 0.0 111.603 173.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 mttm -63.92 -53.3 52.54 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.238 1.015 . . . . 0.0 111.199 177.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -53.46 -55.49 24.83 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.281 0.632 . . . . 0.0 112.275 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -67.79 -37.67 82.34 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.718 0.807 . . . . 0.0 112.67 -176.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.5 -49.41 77.66 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.398 -0.814 . . . . 0.0 111.076 172.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.21 -41.02 87.61 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.464 1.106 . . . . 0.0 112.526 175.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.414 ' HA ' HG22 ' A' ' 94' ' ' ILE . 7.5 mp -66.88 -38.93 87.22 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 119.352 0.978 . . . . 0.0 112.608 172.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.5 t -71.4 -42.63 68.1 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 120.473 -1.392 . . . . 0.0 113.022 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -49.56 68.42 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.324 0.65 . . . . 0.0 109.614 174.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.414 HG22 ' HA ' ' A' ' 91' ' ' LEU . 8.8 tp -65.46 -28.14 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -178.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.61 -26.87 68.26 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 177.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 . . . . . 0 CA--C 1.547 0.832 0 C-N-CA 124.379 1.071 . . . . 0.0 113.173 173.891 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -43.71 -35.8 1.97 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.502 1.521 . . . . 0.0 114.032 170.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -60.95 -59.38 5.46 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.599 0.76 . . . . 0.0 111.536 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.11 -31.54 72.79 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.831 0.741 . . . . 0.0 111.892 -176.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.36 -52.33 65.71 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.451 0.301 . . . . 0.0 111.445 172.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -54.67 -46.87 74.1 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 117.91 -1.043 . . . . 0.0 111.646 174.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 27.4 mm -52.97 -49.81 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.355 1.062 . . . . 0.0 111.731 174.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 68.6 mm-40 -64.41 -46.22 84.21 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.064 1.302 . . . . 0.0 112.947 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.39 -48.9 77.84 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.124 0.969 . . . . 0.0 111.725 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.59 -40.09 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.161 173.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 87.6 t80 . . . . . 0 N--CA 1.474 0.745 0 CA-C-N 120.304 1.411 . . . . 0.0 113.439 -179.465 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo . . . . . 0 CA--C 1.537 0.625 0 CA-C-O 121.638 0.599 . . . . 0.0 112.188 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -60.89 -24.66 66.15 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 174.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 71.5 m -62.7 -51.61 66.54 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 120.009 1.277 . . . . 0.0 112.044 176.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.6 p -70.22 -38.94 76.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 121.905 -0.497 . . . . 0.0 111.137 176.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.2 tttt -61.21 -45.69 93.52 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.109 0.868 . . . . 0.0 112.071 177.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -69.87 -39.43 76.32 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.057 0.943 . . . . 0.0 113.05 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -67.54 -36.74 81.56 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.199 -0.938 . . . . 0.0 112.412 176.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.23 -19.44 31.64 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.351 1.06 . . . . 0.0 113.26 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 . . . . . 0 N--CA 1.479 0.986 0 C-N-CA 125.951 1.7 . . . . 0.0 113.833 178.158 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo . . . . . 0 CA--C 1.54 0.821 0 CA-C-O 119.154 -0.436 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -68.67 -23.06 36.76 Favored 'Trans proline' 0 CA--C 1.551 1.335 0 CA-C-O 115.882 -1.799 . . . . 0.0 115.511 167.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.02 160.47 49.22 Favored 'Trans proline' 0 C--N 1.363 1.314 0 CA-C-N 124.122 2.508 . . . . 0.0 112.537 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -64.87 130.14 25.24 Favored 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 123.54 2.827 . . . . 0.0 111.454 174.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -52.1 -49.78 62.92 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.125 -0.984 . . . . 0.0 112.505 174.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.16 -2.07 17.33 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -15.48 99.12 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.782 2.833 . . . . 0.0 115.192 -175.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 162.61 -21.69 0.19 Allowed Glycine 0 CA--C 1.537 1.413 0 C-N-CA 124.549 1.071 . . . . 0.0 114.98 -177.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.17 161.56 72.63 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 124.54 1.136 . . . . 0.0 113.135 176.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.47 172.67 15.67 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.438 2.758 . . . . 0.0 113.991 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -52.84 -36.34 58.66 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.991 1.316 . . . . 0.0 113.33 -179.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -54.05 -39.91 66.64 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.513 1.525 . . . . 0.0 112.7 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 72.3 t -83.29 -39.87 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.536 1.534 . . . . 0.0 111.754 176.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 59.4 t -55.9 -39.72 58.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.066 0.946 . . . . 0.0 111.022 177.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 tptm -60.57 -50.64 72.74 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.718 0.807 . . . . 0.0 111.935 172.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.78 -47.15 74.32 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.672 0.669 . . . . 0.0 111.945 178.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.52 ' CD1' HD11 ' A' ' 40' ' ' LEU . 10.3 t80 -53.48 -53.47 51.03 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.459 1.104 . . . . 0.0 112.06 168.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.21 -47.42 83.51 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 119.086 0.857 . . . . 0.0 113.136 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.15 -37.65 88.07 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.793 0.837 . . . . 0.0 112.054 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.9 tp -60.57 -52.55 64.67 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.559 0.744 . . . . 0.0 111.193 171.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.562 HD21 HD21 ' A' ' 40' ' ' LEU . 3.8 mm? -71.28 -27.34 63.36 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.019 1.328 . . . . 0.0 113.601 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.5 mmtt -52.48 -48.07 66.15 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.029 1.731 . . . . 0.0 112.687 173.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 tttt -67.08 -24.03 65.92 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 178.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -109.75 30.48 6.64 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.32 2.248 . . . . 0.0 112.46 178.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -54.83 -23.3 17.68 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 119.976 -1.703 . . . . 0.0 113.917 -173.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.7 p -77.08 8.17 4.19 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.715 2.806 . . . . 0.0 114.989 172.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.09 171.95 0.23 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.25 1.82 . . . . 0.0 114.112 170.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 m -138.17 170.07 16.68 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 127.773 2.429 . . . . 0.0 109.409 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -40.14 -56.76 3.17 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 127.335 2.254 . . . . 0.0 113.436 175.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.64 -36.51 14.36 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 122.51 2.14 . . . . 0.0 113.856 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.93 -40.91 95.76 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.556 1.071 . . . . 0.0 111.064 178.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 22.6 mt -62.57 -53.39 47.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.44 -38.45 91.17 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 119.017 -1.073 . . . . 0.0 111.909 -175.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.7 ttmt -65.19 -60.17 3.29 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 125.103 1.361 . . . . 0.0 112.138 177.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -59.41 -38.62 81.07 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.678 0.672 . . . . 0.0 112.197 -179.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.58 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.0 OUTLIER -66.22 -51.15 60.46 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.474 176.4 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -59.01 -33.3 70.56 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.99 -52.17 65.14 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.686 ' CH2' HD11 ' A' ' 47' ' ' LEU . 8.7 p-90 -73.91 -35.02 64.59 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 114.376 1.251 . . . . 0.0 114.376 169.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -57.6 -27.8 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 O-C-N 120.266 -1.521 . . . . 0.0 111.795 176.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -56.17 -25.75 47.86 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.775 0.83 . . . . 0.0 112.501 176.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 38.7 p -88.65 -20.97 24.22 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.686 HD11 ' CH2' ' A' ' 43' ' ' TRP . 41.3 mt . . . . . 0 CA--C 1.541 0.616 0 CA-C-N 118.433 0.56 . . . . 0.0 111.909 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 . . . . . 0 N--CA 1.473 0.693 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.72 -53.31 56.32 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.525 1.13 . . . . 0.0 112.917 176.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 6.2 mtpp -56.66 -36.17 69.25 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 119.053 -0.499 . . . . 0.0 111.847 174.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.14 -49.9 52.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.814 0.846 . . . . 0.0 111.673 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.9 tttt -58.95 -51.16 71.24 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.412 1.085 . . . . 0.0 110.827 177.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.94 -50.1 74.78 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.682 1.193 . . . . 0.0 112.134 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.52 -49.97 71.18 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.179 0.9 . . . . 0.0 113.118 176.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -63.96 -47.11 81.71 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.465 0.706 . . . . 0.0 112.505 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.6 mt -56.46 -46.79 80.19 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.897 0.879 . . . . 0.0 112.032 173.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.25 -48.43 81.49 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.273 1.029 . . . . 0.0 111.182 177.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -50.87 67.41 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 119.963 1.256 . . . . 0.0 112.039 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.61 -48.92 75.38 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.376 0.67 . . . . 0.0 112.345 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.9 m80 -55.51 -54.09 48.29 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.961 0.904 . . . . 0.0 111.515 173.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -54.52 -41.04 69.21 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.897 1.679 . . . . 0.0 112.673 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -51.3 69.34 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.822 0.849 . . . . 0.0 111.935 174.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.07 -29.29 69.03 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 175.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 63.8 t -73.02 -28.44 26.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.65 1.98 . . . . 0.0 112.286 175.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.86 -36.36 58.9 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 174.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -90.98 2.17 56.49 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.642 1.577 . . . . 0.0 113.987 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 3.9 ttm -97.43 -77.02 0.5 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.421 1.488 . . . . 0.0 111.519 -174.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.71 149.56 73.33 Favored Pre-proline 0 N--CA 1.481 1.122 0 C-N-CA 126.285 1.834 . . . . 0.0 112.806 -176.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.24 -46.53 0.66 Allowed 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.768 2.978 . . . . 0.0 113.184 -177.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -68.02 -33.06 73.87 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.565 1.146 . . . . 0.0 112.523 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.59 76.04 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.915 0.486 . . . . 0.0 111.228 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.11 -51.77 65.36 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.857 0.753 . . . . 0.0 110.594 169.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -57.27 -54.7 43.82 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.513 1.125 . . . . 0.0 110.849 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.48 -52.53 65.2 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.22 -34.86 78.98 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.352 0.661 . . . . 0.0 112.432 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.3 -48.12 76.85 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 119.716 1.143 . . . . 0.0 110.774 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.25 -45.68 76.08 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.051 0.941 . . . . 0.0 112.34 171.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 8.3 tp -63.1 -39.14 93.82 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 118.836 0.744 . . . . 0.0 112.67 174.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.0 t -71.92 -41.72 67.54 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 120.603 -1.31 . . . . 0.0 112.238 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.61 -42.49 78.06 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.283 0.633 . . . . 0.0 110.869 176.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.9 tp -70.07 -31.46 47.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 118.46 0.573 . . . . 0.0 112.311 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.09 -31.7 72.17 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 . . . . . 0 CA--C 1.545 0.781 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 172.486 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -47.96 -34.19 8.84 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.508 1.523 . . . . 0.0 113.536 172.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -59.2 5.77 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 118.775 0.716 . . . . 0.0 111.304 173.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.89 79.23 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.538 0.735 . . . . 0.0 112.488 -179.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -53.91 -52.23 61.2 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.421 1.088 . . . . 0.0 110.714 169.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -49.61 75.54 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 117.631 -1.176 . . . . 0.0 111.509 175.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.5 mm -54.21 -49.58 61.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 119.53 1.059 . . . . 0.0 111.501 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 69.5 mm-40 -62.06 -44.74 96.03 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.301 -0.874 . . . . 0.0 112.369 176.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.61 -48.95 78.58 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 119.131 0.878 . . . . 0.0 112.329 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -67.15 -35.76 75.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.514 0.725 . . . . 0.0 111.85 176.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.7 t80 . . . . . 0 CA--C 1.542 0.662 0 C-N-CA 123.881 0.872 . . . . 0.0 112.947 175.242 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo . . . . . 0 CA--C 1.535 0.54 0 CA-C-O 121.863 0.693 . . . . 0.0 112.645 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -61.45 -27.6 68.68 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.538 -0.726 . . . . 0.0 112.174 177.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 22.7 t -61.14 -51.69 68.01 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.641 1.109 . . . . 0.0 112.129 177.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.2 p -74.99 -38.76 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.612 -0.68 . . . . 0.0 111.804 178.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -56.98 -51.15 70.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.626 171.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -63.95 -43.52 95.57 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.015 1.28 . . . . 0.0 112.699 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -66.51 -34.43 77.89 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.256 0.935 . . . . 0.0 112.804 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.34 -23.88 24.46 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.207 1.003 . . . . 0.0 113.242 178.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 . . . . . 0 N--CA 1.48 1.046 0 C-N-CA 126.472 1.909 . . . . 0.0 113.187 -179.971 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo . . . . . 0 CA--C 1.541 0.826 0 CA-C-O 119.14 -0.441 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -71.6 -21.3 25.82 Favored 'Trans proline' 0 CA--C 1.553 1.433 0 CA-C-O 115.714 -1.869 . . . . 0.0 116.287 167.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.83 165.98 29.22 Favored 'Trans proline' 0 C--N 1.362 1.275 0 CA-C-N 124.36 2.593 . . . . 0.0 112.356 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.432 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 35.2 Cg_endo -58.77 131.5 42.45 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.52 2.146 . . . . 0.0 111.019 169.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -49.89 -49.6 49.01 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.999 0.52 . . . . 0.0 110.734 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.546 HD23 ' H ' ' A' ' 10' ' ' LEU . 2.2 pt? -80.24 28.54 0.3 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.671 1.988 . . . . 0.0 115.081 176.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -40.32 107.62 0.07 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.494 1.518 . . . . 0.0 114.297 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.55 17.11 0.3 Allowed Glycine 0 CA--C 1.537 1.466 0 C-N-CA 124.784 1.183 . . . . 0.0 115.044 -174.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.67 158.23 36.15 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.842 1.657 . . . . 0.0 112.132 -173.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -73.0 167.18 28.05 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.778 2.319 . . . . 0.0 112.732 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -53.78 -38.74 64.78 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.61 1.164 . . . . 0.0 113.093 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.96 -40.14 63.48 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.586 1.554 . . . . 0.0 112.825 173.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.9 t -82.75 -39.71 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.029 1.332 . . . . 0.0 111.713 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.8 t -56.03 -40.25 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.863 0.756 . . . . 0.0 110.955 176.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.4 tptt -61.26 -50.52 72.7 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.081 -1.012 . . . . 0.0 111.866 174.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.0 75.01 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.43 0.692 . . . . 0.0 112.025 178.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.432 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 1.5 t80 -52.82 -53.75 44.11 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.728 1.211 . . . . 0.0 112.273 168.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.66 -47.37 85.9 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.646 1.112 . . . . 0.0 113.579 -178.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -61.15 -38.77 87.62 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.849 0.86 . . . . 0.0 111.407 176.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.5 tp -64.15 -47.69 78.92 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 121.819 -0.55 . . . . 0.0 111.465 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.61 -35.52 76.32 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.576 1.55 . . . . 0.0 114.26 -178.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.22 -31.0 61.12 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.348 1.431 . . . . 0.0 113.025 175.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -70.38 -36.43 74.11 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.721 1.608 . . . . 0.0 112.507 176.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -109.81 20.18 18.31 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.438 1.895 . . . . 0.0 112.375 -176.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -26.1 66.6 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.053 -1.654 . . . . 0.0 113.5 -175.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 33.0 p -85.27 -0.32 54.33 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.659 2.384 . . . . 0.0 114.379 177.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -82.69 167.91 17.76 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 125.418 1.487 . . . . 0.0 112.609 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.21 171.52 9.44 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.926 2.09 . . . . 0.0 111.94 178.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -46.04 -61.16 2.73 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 126.746 2.018 . . . . 0.0 112.595 172.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.35 -38.32 20.75 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 121.894 1.729 . . . . 0.0 112.744 177.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -42.07 99.35 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 120.444 -1.41 . . . . 0.0 112.684 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.1 mt -68.18 -53.34 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 124.25 1.02 . . . . 0.0 110.385 173.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -56.9 -37.62 71.67 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.368 0.986 . . . . 0.0 112.468 -174.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -59.47 -56.99 15.07 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.146 1.378 . . . . 0.0 111.919 177.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -65.59 -35.2 80.15 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.688 0.395 . . . . 0.0 111.919 -178.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.775 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.8 mm? -61.32 -51.07 70.4 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.053 1.341 . . . . 0.0 112.229 170.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -60.71 -36.94 80.07 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.25 -0.906 . . . . 0.0 112.862 177.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.34 -49.16 72.95 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.775 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.2 p-90 -73.7 -35.59 65.15 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 170.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -56.63 -31.59 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 125.393 1.477 . . . . 0.0 112.229 175.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -57.6 -19.61 27.16 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 119.027 0.831 . . . . 0.0 112.906 176.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.7 -15.35 23.98 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.119 1.367 . . . . 0.0 113.727 174.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.674 HD11 ' CH2' ' A' ' 43' ' ' TRP . 48.7 mt . . . . . 0 N--CA 1.472 0.663 0 CA-C-N 118.924 0.784 . . . . 0.0 112.453 174.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 . . . . . 0 N--CA 1.47 0.56 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -61.61 -53.34 57.52 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.897 0.879 . . . . 0.0 112.869 176.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt -60.67 -32.29 71.5 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 118.997 -0.525 . . . . 0.0 111.82 175.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.34 -51.61 35.3 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.796 0.838 . . . . 0.0 111.15 178.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.8 ttmt -61.06 -48.1 83.29 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.214 0.461 . . . . 0.0 110.593 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.94 -51.82 68.06 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.578 1.151 . . . . 0.0 112.707 177.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.67 -43.75 90.01 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.782 1.174 . . . . 0.0 112.858 177.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -63.22 -50.45 70.19 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.656 0.782 . . . . 0.0 112.022 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.3 mt -57.1 -50.81 71.63 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.113 0.965 . . . . 0.0 111.171 176.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.42 -45.33 84.74 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.991 0.917 . . . . 0.0 112.283 175.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -59.04 -50.78 72.79 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-N 120.766 1.621 . . . . 0.0 111.781 177.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.28 75.81 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -56.63 -52.28 65.46 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.932 0.893 . . . . 0.0 110.699 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.45 -41.61 73.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.973 1.309 . . . . 0.0 113.224 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -57.83 -52.42 65.53 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.931 0.892 . . . . 0.0 112.255 173.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.57 -36.06 82.66 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 176.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 37.3 t -68.59 -27.83 37.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 126.321 1.848 . . . . 0.0 113.166 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.6 -29.29 37.0 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 175.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.6 pttt -105.89 0.43 25.89 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.187 1.795 . . . . 0.0 113.795 176.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 45.8 ttm -93.44 -80.55 0.38 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.127 1.771 . . . . 0.0 111.799 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.91 143.82 49.15 Favored Pre-proline 0 N--CA 1.48 1.041 0 C-N-CA 126.997 2.119 . . . . 0.0 112.655 -175.024 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -68.21 -49.83 0.88 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 123.666 2.91 . . . . 0.0 113.304 -178.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.43 -37.01 86.04 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.241 1.416 . . . . 0.0 113.04 176.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.4 -40.09 95.13 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 118.761 -0.638 . . . . 0.0 110.062 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 12.5 tppt? -55.76 -50.18 71.13 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.478 171.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 50.4 mmtt -54.96 -54.6 40.74 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.266 0.939 . . . . 0.0 110.727 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.38 -47.57 81.5 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -71.0 -38.93 72.67 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.107 0.963 . . . . 0.0 112.285 -177.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.25 -47.88 82.4 Favored 'General case' 0 N--CA 1.465 0.297 0 O-C-N 121.052 -1.03 . . . . 0.0 111.409 171.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -56.85 -43.7 81.41 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.757 0.708 . . . . 0.0 112.225 172.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 13.0 tp -62.44 -39.94 94.97 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.722 1.147 . . . . 0.0 113.018 172.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.5 t -70.67 -45.16 65.59 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.857 -1.152 . . . . 0.0 112.81 -177.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -41.93 79.71 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.6 0.76 . . . . 0.0 110.984 175.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.3 tt -70.85 -29.73 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 179.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.49 -34.83 71.34 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 . . . . . 0 CA--C 1.544 0.746 0 C-N-CA 124.399 1.08 . . . . 0.0 113.479 172.133 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 2.4 tp . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -46.64 -38.1 9.2 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.484 1.113 . . . . 0.0 113.092 173.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -62.52 -59.15 5.35 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.552 0.741 . . . . 0.0 112.039 171.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.5 -36.13 83.19 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.976 0.91 . . . . 0.0 112.815 -175.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -53.68 -54.65 34.9 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 126.636 1.974 . . . . 0.0 110.866 166.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.0 tttt -52.63 -52.09 57.08 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 117.686 -1.15 . . . . 0.0 110.597 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.9 mm -52.27 -50.96 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 119.44 1.018 . . . . 0.0 111.471 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -64.84 -42.57 94.8 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.1 0.864 . . . . 0.0 112.549 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.52 -36.13 83.22 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.887 1.275 . . . . 0.0 113.044 179.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.7 pp -78.13 -42.56 27.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 119.165 0.893 . . . . 0.0 111.856 170.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 58.6 t80 . . . . . 0 N--CA 1.473 0.725 0 C-N-CA 124.84 1.256 . . . . 0.0 113.187 179.149 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo . . . . . 0 CA--C 1.538 0.704 0 CA-C-O 121.498 0.541 . . . . 0.0 112.899 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -63.39 -20.49 65.59 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 175.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.2 p -65.42 -51.55 59.52 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.933 1.242 . . . . 0.0 112.21 176.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.2 p -72.56 -39.08 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.649 -0.657 . . . . 0.0 111.424 176.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 29.1 mtmt -57.87 -50.15 74.3 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.034 0.834 . . . . 0.0 111.8 173.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -65.88 -40.76 91.9 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.552 1.069 . . . . 0.0 113.551 177.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.22 -35.35 79.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.575 1.08 . . . . 0.0 112.873 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.46 -23.33 26.03 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.356 1.063 . . . . 0.0 113.418 178.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 . . . . . 0 N--CA 1.48 1.054 0 C-N-CA 126.609 1.964 . . . . 0.0 113.834 177.095 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo . . . . . 0 CA--C 1.547 1.158 0 CA-C-O 119.147 -0.439 . . . . 0.0 111.726 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.04 -21.43 27.61 Favored 'Trans proline' 0 CA--C 1.555 1.569 0 C-N-CA 122.523 2.149 . . . . 0.0 116.55 166.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.36 170.25 17.73 Favored 'Trans proline' 0 C--N 1.363 1.308 0 CA-C-N 124.18 2.529 . . . . 0.0 112.762 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -62.47 123.64 12.78 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.578 2.186 . . . . 0.0 110.846 173.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -52.87 -38.2 61.32 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 122.163 0.982 . . . . 0.0 111.868 169.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.492 ' HB3' HG21 ' A' ' 44' ' ' VAL . 0.5 OUTLIER -83.82 22.42 1.13 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 128.709 2.804 . . . . 0.0 115.064 175.324 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -41.0 113.22 0.37 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.657 1.583 . . . . 0.0 113.44 175.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.94 23.28 0.19 Allowed Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.207 1.384 . . . . 0.0 114.742 -175.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -125.2 158.85 62.18 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 125.789 1.636 . . . . 0.0 112.347 -172.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.37 170.72 19.69 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.211 2.607 . . . . 0.0 113.106 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -52.45 -38.27 58.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.81 1.244 . . . . 0.0 113.277 -177.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -56.22 -40.2 73.7 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.623 1.569 . . . . 0.0 112.349 176.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 79.7 t -79.46 -39.55 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.963 1.305 . . . . 0.0 111.809 174.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 57.8 t -55.65 -38.94 52.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.0 0.92 . . . . 0.0 111.037 177.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -60.43 -50.63 72.81 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.799 -1.188 . . . . 0.0 112.221 174.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.67 -47.62 79.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.361 1.064 . . . . 0.0 111.616 177.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.63 -51.7 46.45 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.167 0.987 . . . . 0.0 111.671 168.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.54 -47.15 86.88 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 120.183 1.356 . . . . 0.0 113.287 -176.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -65.45 -34.18 77.68 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 122.545 0.338 . . . . 0.0 111.692 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.95 -54.63 14.32 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 173.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.6 HD22 HD21 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -57.26 -34.17 68.36 Favored 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 123.871 0.868 . . . . 0.0 112.517 -178.503 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -51.5 -30.54 20.51 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 171.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.8 tttt -74.91 -36.08 62.22 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.778 1.231 . . . . 0.0 113.145 173.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -102.64 15.08 30.32 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.499 1.52 . . . . 0.0 113.052 -177.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -63.36 -19.74 64.91 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.477 -1.39 . . . . 0.0 113.385 -172.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -100.4 1.04 40.99 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 126.947 2.099 . . . . 0.0 113.773 -178.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -79.38 177.73 8.63 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.786 1.635 . . . . 0.0 111.819 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.93 172.1 8.36 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.864 2.066 . . . . 0.0 111.938 177.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -49.56 -59.24 7.05 Favored Pre-proline 0 CA--C 1.546 0.793 0 C-N-CA 124.721 1.208 . . . . 0.0 113.107 175.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.21 -36.93 15.3 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.868 1.712 . . . . 0.0 112.607 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.74 -49.41 77.6 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.896 -1.127 . . . . 0.0 112.182 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.0 mt -61.94 -53.42 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-O 117.928 -1.034 . . . . 0.0 109.289 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -51.83 -44.87 63.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.301 1.41 . . . . 0.0 111.677 -176.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -51.13 68.34 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 125.108 1.363 . . . . 0.0 112.994 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.62 -39.14 92.87 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.106 0.562 . . . . 0.0 112.479 176.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.72 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.4 mm? -61.68 -50.18 73.52 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.518 1.127 . . . . 0.0 109.848 173.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.567 ' HA ' HG12 ' A' ' 44' ' ' VAL . 3.8 m-20 -62.74 -28.38 69.93 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 178.24 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.34 -54.8 39.09 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.465 -0.772 . . . . 0.0 112.667 174.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.72 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.3 p-90 -73.84 -30.42 62.66 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 175.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.804 HG23 HD12 ' A' ' 47' ' ' LEU . 0.3 OUTLIER -67.35 -29.67 46.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 120.623 -1.298 . . . . 0.0 112.667 175.567 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -58.95 -15.55 13.48 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.012 0.824 . . . . 0.0 113.147 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.9 p -115.07 -2.99 12.64 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.363 1.465 . . . . 0.0 113.56 177.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.804 HD12 HG23 ' A' ' 44' ' ' VAL . 9.7 mt . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 175.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 . . . . . 0 N--CA 1.473 0.717 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.0 ttt -64.01 -51.28 64.95 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.631 0.772 . . . . 0.0 112.424 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -52.93 -40.04 63.31 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 122.972 0.509 . . . . 0.0 111.86 172.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.14 -48.84 64.27 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.336 0.655 . . . . 0.0 111.244 -178.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -60.13 -53.08 62.03 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.046 0.938 . . . . 0.0 110.389 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -60.12 -50.46 73.6 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.569 1.147 . . . . 0.0 112.437 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.68 -47.33 86.08 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.261 0.937 . . . . 0.0 112.176 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.31 -45.12 85.64 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.252 -0.905 . . . . 0.0 112.823 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.4 mp -56.18 -47.64 77.9 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.735 0.814 . . . . 0.0 110.535 171.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.49 -47.18 84.93 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 117.678 -1.153 . . . . 0.0 111.933 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -56.18 -50.31 71.56 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 121.609 2.004 . . . . 0.0 113.376 175.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.07 -50.35 70.94 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.796 -0.565 . . . . 0.0 112.239 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 34.2 m170 -55.97 -41.13 74.28 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-O 117.694 -1.146 . . . . 0.0 111.354 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -51.03 71.71 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 126.182 1.793 . . . . 0.0 112.398 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -58.99 -47.16 86.15 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.3 176.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.1 -51.04 63.71 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 176.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 41.5 t -59.42 -28.56 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 126.976 2.11 . . . . 0.0 112.586 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.93 -28.57 24.12 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 173.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -101.73 -0.51 34.31 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.028 1.331 . . . . 0.0 114.354 176.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.1 mmt -88.23 -85.73 0.18 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.594 1.158 . . . . 0.0 110.775 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -129.7 155.22 80.71 Favored Pre-proline 0 N--CA 1.476 0.853 0 C-N-CA 127.039 2.135 . . . . 0.0 112.945 -176.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.5 -51.79 0.31 Allowed 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.76 2.973 . . . . 0.0 112.846 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -62.85 -34.18 76.82 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.463 1.505 . . . . 0.0 113.217 177.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -42.61 99.75 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 118.938 -0.553 . . . . 0.0 110.437 178.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.53 -45.85 77.11 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 117.909 -1.043 . . . . 0.0 110.951 171.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.4 mttt -58.08 -54.76 43.35 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.122 1.328 . . . . 0.0 111.839 177.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.62 -54.98 40.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.452 0.701 . . . . 0.0 112.498 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.68 -46.88 77.53 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.331 1.052 . . . . 0.0 112.758 175.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.84 -43.33 99.06 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.55 1.068 . . . . 0.0 111.502 -179.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.18 -46.91 82.42 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.082 0.953 . . . . 0.0 111.881 170.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.434 ' HA ' HG22 ' A' ' 94' ' ' ILE . 6.9 mp -63.53 -32.51 73.99 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 173.52 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.3 t -73.25 -41.45 63.67 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.783 1.233 . . . . 0.0 112.571 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -71.36 -44.36 65.17 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.485 -0.759 . . . . 0.0 111.023 176.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.434 HG22 ' HA ' ' A' ' 91' ' ' LEU . 15.8 tt -69.53 -30.07 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 178.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.06 -41.78 68.53 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.134 0.879 . . . . 0.0 112.388 176.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 . . . . . 0 CA--C 1.544 0.744 0 C-N-CA 124.858 1.263 . . . . 0.0 113.518 177.178 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.457 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.477 0.882 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.44 -37.68 39.39 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.417 1.087 . . . . 0.0 112.94 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.5 mtmt -60.32 -59.41 5.45 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.599 0.76 . . . . 0.0 111.135 173.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.457 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -62.88 -36.17 82.43 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.72 0.808 . . . . 0.0 112.916 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.7 -53.23 57.58 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.42 1.088 . . . . 0.0 110.802 170.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 50.6 tttt -55.04 -50.69 68.44 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.654 0.782 . . . . 0.0 111.66 175.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 23.5 mm -51.6 -48.75 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.688 1.195 . . . . 0.0 111.059 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -64.87 -42.58 94.73 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 120.17 1.35 . . . . 0.0 113.025 177.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.94 -40.96 99.22 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.856 0.863 . . . . 0.0 112.979 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -75.88 -35.39 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 121.378 -0.827 . . . . 0.0 111.782 172.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 47.7 t80 . . . . . 0 N--CA 1.469 0.508 0 C-N-CA 124.619 1.168 . . . . 0.0 112.889 179.491 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo . . . . . 0 CA--C 1.537 0.632 0 CA-C-O 121.824 0.677 . . . . 0.0 112.586 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -26.28 53.92 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 174.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.2 t -59.4 -51.65 68.98 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.629 1.104 . . . . 0.0 111.924 179.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.8 -49.19 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.706 -0.621 . . . . 0.0 109.759 173.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -58.42 -37.52 75.54 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.59 -171.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -67.85 -46.28 72.2 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.78 1.632 . . . . 0.0 113.675 170.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -59.43 -34.08 72.04 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.85 1.204 . . . . 0.0 112.959 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.4 pp -91.87 -20.86 21.0 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.784 1.234 . . . . 0.0 113.651 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.475 0.804 0 CA-C-N 119.745 1.157 . . . . 0.0 112.412 171.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 CA--C 1.546 1.076 0 CA-C-O 119.126 -0.448 . . . . 0.0 111.688 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -71.81 -22.09 24.06 Favored 'Trans proline' 0 CA--C 1.553 1.455 0 C-N-CA 122.102 1.868 . . . . 0.0 116.469 167.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.88 166.45 27.7 Favored 'Trans proline' 0 C--N 1.363 1.326 0 CA-C-N 124.332 2.583 . . . . 0.0 112.276 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.422 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 40.2 Cg_endo -58.82 129.39 31.95 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.706 2.27 . . . . 0.0 110.843 171.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -48.68 -48.59 39.89 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 122.826 0.45 . . . . 0.0 111.296 172.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.583 HD23 ' H ' ' A' ' 10' ' ' LEU . 1.9 pt? -83.33 29.29 0.5 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.508 1.923 . . . . 0.0 114.419 178.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -37.6 104.19 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.035 1.734 . . . . 0.0 114.919 -179.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 147.55 11.0 0.18 Allowed Glycine 0 CA--C 1.542 1.741 0 C-N-CA 125.626 1.584 . . . . 0.0 115.683 -173.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -109.54 159.26 32.18 Favored Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 125.745 1.618 . . . . 0.0 112.612 -172.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -73.98 169.55 22.14 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 123.019 2.479 . . . . 0.0 113.32 179.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -54.62 -38.09 66.39 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.656 1.183 . . . . 0.0 113.267 -177.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -53.39 -39.98 64.69 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.74 1.616 . . . . 0.0 112.486 174.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.2 t -82.08 -38.96 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 124.863 1.265 . . . . 0.0 112.077 176.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.7 t -56.71 -38.77 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 119.02 0.827 . . . . 0.0 111.337 176.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -62.65 -50.38 71.44 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.366 -0.834 . . . . 0.0 112.549 174.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.39 -47.76 75.35 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.083 0.953 . . . . 0.0 111.704 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.422 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 15.5 t80 -51.18 -52.96 39.27 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.265 1.026 . . . . 0.0 111.897 168.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -47.4 85.72 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.02 0.827 . . . . 0.0 113.124 -177.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -65.18 -37.84 88.62 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.229 0.612 . . . . 0.0 111.772 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.2 tp -59.27 -52.24 66.49 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.063 0.545 . . . . 0.0 110.884 169.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.62 -29.11 70.37 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -179.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.9 mttm -54.15 -35.56 62.37 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.349 1.431 . . . . 0.0 112.9 172.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.57 -32.8 60.52 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.29 1.036 . . . . 0.0 113.118 175.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -97.69 16.65 19.95 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.166 1.786 . . . . 0.0 113.367 179.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.6 -17.05 64.3 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 119.787 -1.82 . . . . 0.0 113.867 -170.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.7 p -100.82 1.58 40.26 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 128.051 2.54 . . . . 0.0 113.771 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -79.72 165.48 22.78 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.921 1.688 . . . . 0.0 112.592 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.89 171.02 9.89 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.962 1.705 . . . . 0.0 111.97 176.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -47.91 -59.76 5.3 Favored Pre-proline 0 N--CA 1.474 0.732 0 C-N-CA 126.343 1.857 . . . . 0.0 113.078 174.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -65.16 -30.61 55.26 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 122.118 1.879 . . . . 0.0 113.43 179.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.44 -44.95 63.89 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.639 1.175 . . . . 0.0 111.963 -178.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 80.0 mt -66.57 -53.04 39.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.702 0.801 . . . . 0.0 109.647 172.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.95 -36.49 72.61 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 118.774 0.715 . . . . 0.0 111.837 -174.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -61.41 -60.44 3.71 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 125.382 1.473 . . . . 0.0 113.687 175.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -35.62 75.74 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.823 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.8 mm? -63.79 -51.0 66.77 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.501 1.121 . . . . 0.0 112.194 172.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -57.48 -36.71 71.84 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.022 0.828 . . . . 0.0 113.141 175.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.32 -51.1 67.81 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -178.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.823 ' HE1' HD13 ' A' ' 40' ' ' LEU . 6.9 p-90 -73.92 -32.51 63.57 Favored 'General case' 0 CA--C 1.553 1.093 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 170.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.72 -31.16 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 O-C-N 120.584 -1.323 . . . . 0.0 112.017 173.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -55.95 -24.14 36.34 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.065 0.848 . . . . 0.0 112.384 177.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.59 -16.99 26.27 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.031 1.333 . . . . 0.0 113.28 177.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.703 HD11 ' CH2' ' A' ' 43' ' ' TRP . 62.8 mt . . . . . 0 N--CA 1.473 0.718 0 CA-C-N 118.669 0.668 . . . . 0.0 112.485 174.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 ppp? -60.41 -51.76 68.09 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 176.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -56.39 -35.93 68.3 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.181 0.592 . . . . 0.0 112.478 175.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.01 -51.49 46.53 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.52 0.728 . . . . 0.0 111.155 178.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.4 tttt -60.39 -49.68 76.6 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.52 0.728 . . . . 0.0 111.001 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -61.59 -51.25 69.3 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.272 1.429 . . . . 0.0 112.506 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.94 -44.18 91.36 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.634 1.106 . . . . 0.0 112.525 176.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.81 -51.14 69.48 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.832 0.853 . . . . 0.0 111.792 177.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.6 mt -54.62 -51.16 66.23 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.261 1.024 . . . . 0.0 111.104 174.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.12 -44.38 87.72 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.214 1.006 . . . . 0.0 112.66 178.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.1 tttm -58.33 -50.66 72.85 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.81 1.244 . . . . 0.0 112.0 176.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.62 -46.42 88.35 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.644 0.778 . . . . 0.0 112.221 178.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.99 -51.33 70.1 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.817 0.847 . . . . 0.0 110.831 176.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -54.52 -46.49 73.53 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.979 1.312 . . . . 0.0 112.815 174.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -55.65 -50.1 71.13 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.669 0.788 . . . . 0.0 112.525 175.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -68.32 -30.86 69.94 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 176.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 63.3 t -72.93 -24.83 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 126.376 1.87 . . . . 0.0 113.42 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.67 -30.3 65.33 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 178.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.2 pttt -86.82 1.08 53.55 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.331 1.453 . . . . 0.0 114.492 173.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.6 ttm -103.88 -159.02 0.7 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.839 2.056 . . . . 0.0 111.568 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.47 156.63 21.75 Favored Pre-proline 0 N--CA 1.479 1.019 0 C-N-CA 125.424 1.49 . . . . 0.0 113.97 177.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.43 -46.6 1.29 Allowed 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 123.843 3.029 . . . . 0.0 113.141 -176.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -61.66 -32.12 72.27 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.784 1.233 . . . . 0.0 112.924 176.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.23 -46.98 86.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 122.751 0.42 . . . . 0.0 110.445 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -55.24 -43.55 74.68 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 118.367 -0.825 . . . . 0.0 111.103 174.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? -58.47 -53.17 61.33 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.681 1.128 . . . . 0.0 112.142 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.52 -44.71 95.75 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -73.13 -39.75 65.47 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.38 -47.66 84.82 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.835 0.854 . . . . 0.0 110.532 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -51.3 -51.66 52.24 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.057 0.943 . . . . 0.0 110.941 170.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -37.37 86.07 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.543 0.611 . . . . 0.0 112.446 -179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.7 t -73.27 -43.59 60.77 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.199 -0.938 . . . . 0.0 112.885 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -46.52 73.72 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.367 0.667 . . . . 0.0 110.525 175.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.7 tp -66.65 -33.53 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 118.852 0.751 . . . . 0.0 112.018 -179.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.92 -31.81 72.96 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 177.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 . . . . . 0 N--CA 1.471 0.576 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 176.165 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.458 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.755 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -53.61 -35.07 60.49 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.553 -0.717 . . . . 0.0 112.499 -179.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -56.91 -59.52 4.93 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.006 0.522 . . . . 0.0 111.254 171.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.458 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -65.38 -38.07 88.93 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.313 0.506 . . . . 0.0 112.066 -175.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.03 -51.4 57.7 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.951 1.3 . . . . 0.0 110.459 170.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -57.76 -48.52 79.41 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 118.348 -0.834 . . . . 0.0 112.108 175.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 35.2 mm -52.72 -52.03 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.686 1.194 . . . . 0.0 111.879 177.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 38.5 mm-40 -66.61 -38.67 87.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.145 1.338 . . . . 0.0 112.547 177.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.85 -37.24 81.42 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.574 0.75 . . . . 0.0 112.976 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -84.53 -30.05 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.3 1.04 . . . . 0.0 113.338 172.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 84.1 t80 . . . . . 0 N--CA 1.472 0.629 0 C-N-CA 124.447 1.099 . . . . 0.0 112.788 177.361 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo . . . . . 0 CA--C 1.536 0.603 0 CA-C-O 121.314 0.464 . . . . 0.0 112.157 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -58.76 -25.91 63.5 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 174.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.9 m -62.43 -51.63 66.78 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.865 1.211 . . . . 0.0 111.857 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 10.2 p -70.53 -39.91 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 121.931 -0.48 . . . . 0.0 111.406 175.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -59.19 -47.24 86.05 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.381 0.672 . . . . 0.0 111.243 178.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -68.78 -44.65 73.22 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.244 1.017 . . . . 0.0 112.642 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -63.94 -33.83 76.61 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.893 -1.13 . . . . 0.0 113.076 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.0 -24.06 23.64 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.958 0.903 . . . . 0.0 113.037 177.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 . . . . . 0 N--CA 1.482 1.143 0 C-N-CA 126.189 1.795 . . . . 0.0 113.554 179.712 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo . . . . . 0 CA--C 1.545 1.053 0 N-CA-C 110.989 -0.427 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.53 -23.21 37.45 Favored 'Trans proline' 0 CA--C 1.553 1.458 0 C-N-CA 122.765 2.31 . . . . 0.0 116.768 168.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.14 167.19 24.35 Favored 'Trans proline' 0 C--N 1.361 1.227 0 CA-C-N 124.141 2.515 . . . . 0.0 113.125 175.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.418 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 40.1 Cg_endo -61.4 120.83 8.69 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.117 2.545 . . . . 0.0 111.477 172.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -51.25 -33.76 29.53 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.088 0.955 . . . . 0.0 111.669 171.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.455 ' CD2' HD12 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -101.3 34.09 2.68 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 127.04 2.136 . . . . 0.0 113.702 178.229 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.49 110.67 0.24 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.016 1.326 . . . . 0.0 113.37 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 145.52 11.03 0.26 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.504 1.526 . . . . 0.0 115.24 -173.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.45 158.19 40.63 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.964 1.706 . . . . 0.0 112.575 -171.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.83 170.19 20.62 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 123.228 2.619 . . . . 0.0 112.962 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -54.82 -37.92 66.73 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.494 1.117 . . . . 0.0 113.545 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.45 -39.75 64.7 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.321 1.448 . . . . 0.0 112.512 173.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.5 t -80.69 -41.79 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 124.554 1.142 . . . . 0.0 112.095 175.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.1 t -55.79 -38.97 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 118.922 0.783 . . . . 0.0 111.249 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -60.62 -50.68 72.56 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.181 -0.95 . . . . 0.0 112.266 173.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.35 -47.13 76.2 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.208 1.003 . . . . 0.0 111.529 177.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.418 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -51.79 -53.79 35.95 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.677 1.191 . . . . 0.0 111.995 169.542 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -59.07 -47.51 84.99 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.681 1.128 . . . . 0.0 113.517 -178.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -68.09 -30.23 69.35 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.421 0.689 . . . . 0.0 112.298 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.7 tp -69.06 -45.36 70.57 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 121.556 -0.715 . . . . 0.0 111.646 168.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.16 -45.31 95.17 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.255 1.422 . . . . 0.0 113.943 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -24.52 54.59 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 119.36 0.982 . . . . 0.0 113.547 177.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -75.61 -36.48 60.25 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.535 1.934 . . . . 0.0 112.632 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -109.79 20.47 18.02 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.484 1.914 . . . . 0.0 112.798 178.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.9 -24.53 66.06 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.028 -1.67 . . . . 0.0 112.922 -174.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.67 -1.23 30.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.069 2.148 . . . . 0.0 113.797 178.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -89.75 171.7 9.45 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.745 1.618 . . . . 0.0 112.13 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.56 170.33 11.98 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 126.267 1.827 . . . . 0.0 112.041 175.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -45.45 -62.34 1.8 Allowed Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.501 1.52 . . . . 0.0 112.969 172.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.35 -35.26 24.43 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.034 1.823 . . . . 0.0 114.022 -179.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -60.57 -44.96 95.59 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.116 -0.99 . . . . 0.0 112.234 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 61.6 mt -70.95 -47.75 60.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 118.74 -0.648 . . . . 0.0 111.162 175.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -52.38 -38.75 59.67 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.023 0.829 . . . . 0.0 110.902 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -51.0 71.21 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.671 1.588 . . . . 0.0 112.394 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.64 -38.49 89.51 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.162 0.585 . . . . 0.0 111.901 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.675 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.1 mm? -62.91 -51.09 68.29 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.459 1.103 . . . . 0.0 110.988 173.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -59.75 -34.0 72.39 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.283 1.033 . . . . 0.0 113.621 176.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.3 -52.24 66.42 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.717 -0.614 . . . . 0.0 112.57 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.683 ' CH2' HD11 ' A' ' 47' ' ' LEU . 10.7 p-90 -73.74 -29.85 62.47 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 172.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.409 HG23 HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -60.64 -32.18 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 O-C-N 120.789 -1.194 . . . . 0.0 112.65 174.205 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -58.1 -17.82 20.76 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 175.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.57 -11.89 18.9 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.801 1.24 . . . . 0.0 113.385 177.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.683 HD11 ' CH2' ' A' ' 43' ' ' TRP . 19.9 mt . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 175.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -61.93 -53.27 58.06 Favored 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 123.737 0.815 . . . . 0.0 112.258 176.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -55.13 -36.15 65.45 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.122 0.569 . . . . 0.0 111.894 176.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.81 -51.51 40.02 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.008 0.923 . . . . 0.0 111.509 179.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.7 mttm -59.27 -49.39 78.01 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.338 1.055 . . . . 0.0 111.591 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.35 -54.11 50.54 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.259 1.423 . . . . 0.0 112.096 177.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.3 -44.63 96.9 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.572 1.078 . . . . 0.0 112.841 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -67.66 -45.45 75.25 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.616 -0.678 . . . . 0.0 112.389 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.49 -51.14 67.97 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.002 0.921 . . . . 0.0 110.565 170.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.02 -43.91 91.66 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.293 0.637 . . . . 0.0 112.247 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -56.74 -50.73 71.36 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.795 1.18 . . . . 0.0 112.161 174.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.12 -47.55 82.31 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.14 0.576 . . . . 0.0 112.194 179.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.465 ' O ' HG23 ' A' ' 77' ' ' VAL . 1.1 t-80 -56.79 -49.93 73.85 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.919 1.288 . . . . 0.0 110.744 174.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -52.67 -48.6 66.41 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.92 1.688 . . . . 0.0 111.51 177.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -56.93 -49.5 75.45 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.895 1.278 . . . . 0.0 112.654 176.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.79 -30.84 71.54 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.923 1.082 . . . . 0.0 113.923 172.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 73' ' ' HIS . 96.4 t -72.99 -24.43 20.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.967 1.307 . . . . 0.0 112.675 176.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.416 ' HB2' ' HE2' ' A' ' 85' ' ' LYS . . . -56.89 -28.73 62.24 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 176.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -89.82 1.41 56.19 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.156 1.382 . . . . 0.0 114.573 173.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.4 ttm -105.35 -161.62 0.82 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.795 2.038 . . . . 0.0 111.643 -172.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.9 155.66 22.43 Favored Pre-proline 0 N--CA 1.479 1.01 0 C-N-CA 124.622 1.169 . . . . 0.0 113.536 177.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.46 -42.6 3.56 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 123.387 2.725 . . . . 0.0 112.42 -178.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -63.55 -34.71 78.39 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.308 -0.87 . . . . 0.0 112.645 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.4 -41.28 93.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.744 0.818 . . . . 0.0 110.198 175.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.416 ' HE2' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -55.34 -48.05 74.78 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.89 174.907 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -59.4 -52.45 65.57 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.205 1.002 . . . . 0.0 111.629 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.9 -48.69 80.68 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 177.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -70.56 -42.4 71.19 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.447 -0.783 . . . . 0.0 112.512 -176.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.92 -43.4 98.92 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.083 -1.011 . . . . 0.0 112.2 173.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -54.92 -50.09 69.66 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.481 1.112 . . . . 0.0 111.471 171.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.4 tp -59.7 -37.74 79.69 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 173.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.6 t -73.23 -40.27 64.81 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.59 -1.319 . . . . 0.0 112.923 -177.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.5 ptpm? -69.21 -43.41 74.16 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.847 -0.597 . . . . 0.0 110.779 175.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.4 tt -70.03 -33.18 54.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 119.141 0.882 . . . . 0.0 112.341 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.71 69.48 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.289 1.036 . . . . 0.0 113.426 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.542 0.641 0 C-N-CA 125.303 1.441 . . . . 0.0 113.442 179.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.528 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.48 1.044 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.52 -35.3 39.97 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.692 0.797 . . . . 0.0 112.979 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -59.42 -59.36 5.58 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-O 118.967 -0.539 . . . . 0.0 111.588 171.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.528 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.16 -36.32 83.68 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.039 0.836 . . . . 0.0 112.707 -175.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.8 tm0? -51.72 -54.59 26.67 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.139 1.376 . . . . 0.0 110.791 167.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -57.52 -50.68 72.28 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 117.97 -1.014 . . . . 0.0 112.497 176.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 30.8 mm -52.17 -48.67 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.757 1.223 . . . . 0.0 111.556 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -67.51 -44.22 78.95 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.416 -0.803 . . . . 0.0 112.744 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.8 -37.84 83.34 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.084 0.953 . . . . 0.0 112.819 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -79.34 -34.24 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.021 0.928 . . . . 0.0 112.472 170.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 64.6 t80 . . . . . 0 N--CA 1.473 0.687 0 CA-C-N 119.957 1.253 . . . . 0.0 113.342 177.965 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo . . . . . 0 CA--C 1.533 0.458 0 CA-C-O 121.811 0.671 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -59.24 -24.88 63.56 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 12.7 t -63.0 -51.74 65.69 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.338 0.972 . . . . 0.0 111.875 175.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.7 p -72.89 -39.28 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 O-C-N 121.857 -0.527 . . . . 0.0 111.353 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -57.38 -50.18 73.81 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.11 0.868 . . . . 0.0 111.734 173.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -66.03 -43.43 87.6 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.934 1.243 . . . . 0.0 112.126 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -63.46 -33.63 75.99 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 120.57 -1.331 . . . . 0.0 113.067 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.22 -22.69 22.63 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.208 1.003 . . . . 0.0 113.151 178.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 . . . . . 0 N--CA 1.483 1.216 0 C-N-CA 126.865 2.066 . . . . 0.0 114.137 177.848 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo . . . . . 0 CA--C 1.545 1.055 0 CA-C-O 119.098 -0.459 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -70.44 -22.59 28.76 Favored 'Trans proline' 0 CA--C 1.554 1.478 0 C-N-CA 122.041 1.827 . . . . 0.0 116.279 166.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -70.19 167.75 24.09 Favored 'Trans proline' 0 C--N 1.363 1.3 0 CA-C-N 124.078 2.492 . . . . 0.0 112.913 179.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -61.37 126.77 20.07 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.934 2.423 . . . . 0.0 110.467 172.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -56.73 -43.43 80.65 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 122.062 -0.399 . . . . 0.0 110.644 173.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.468 HD23 ' H ' ' A' ' 10' ' ' LEU . 2.0 pt? -72.59 16.09 0.16 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 126.778 2.031 . . . . 0.0 116.453 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.34 106.71 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.804 2.041 . . . . 0.0 114.724 -174.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.87 30.59 0.17 Allowed Glycine 0 CA--C 1.537 1.458 0 C-N-CA 124.885 1.231 . . . . 0.0 114.837 -172.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -124.72 157.5 65.71 Favored Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 125.487 1.515 . . . . 0.0 111.925 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.412 ' O ' HG23 ' A' ' 18' ' ' VAL . 77.4 Cg_endo -73.18 168.15 25.48 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.304 2.669 . . . . 0.0 112.858 -179.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -52.9 -37.47 60.66 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.667 1.187 . . . . 0.0 113.224 -178.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -57.92 -37.97 75.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.13 1.372 . . . . 0.0 112.643 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 84.6 t -80.12 -40.37 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.116 1.366 . . . . 0.0 111.481 173.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 14' ' ' PRO . 32.2 t -57.02 -37.31 54.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.493 0.717 . . . . 0.0 111.15 178.038 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.9 tppt? -59.26 -50.18 75.0 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 120.545 -1.347 . . . . 0.0 112.223 174.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.15 -46.92 87.12 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.434 0.693 . . . . 0.0 111.263 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -51.97 60.24 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.145 0.978 . . . . 0.0 112.154 170.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -59.56 -47.49 85.36 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.609 1.095 . . . . 0.0 112.789 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -63.92 -37.04 85.93 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.583 0.753 . . . . 0.0 111.932 177.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.7 tp -66.38 -43.92 84.59 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.406 0.682 . . . . 0.0 112.166 173.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.71 -49.1 69.72 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.927 1.291 . . . . 0.0 113.543 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.3 pttt -56.31 -30.75 62.94 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.234 0.925 . . . . 0.0 113.017 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -65.92 -40.65 91.62 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.739 2.016 . . . . 0.0 112.345 174.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -109.73 28.28 8.72 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.568 1.947 . . . . 0.0 112.671 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -66.62 -24.65 66.34 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 119.888 -1.757 . . . . 0.0 112.374 -175.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.7 p -80.22 4.24 18.19 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 127.729 2.411 . . . . 0.0 114.361 177.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -87.51 170.92 10.92 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.431 1.492 . . . . 0.0 112.167 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.82 172.17 8.51 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.851 2.061 . . . . 0.0 111.643 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -51.16 -58.65 9.75 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.063 1.345 . . . . 0.0 112.591 176.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -68.67 -32.04 24.79 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 121.436 1.424 . . . . 0.0 113.128 178.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -65.89 -46.76 77.18 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 121.03 -1.044 . . . . 0.0 112.547 178.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 90.3 mt -65.66 -53.43 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 123.216 0.606 . . . . 0.0 109.555 175.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.09 -36.68 77.93 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 118.122 0.419 . . . . 0.0 112.007 -173.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.4 tttm -57.06 -57.07 14.17 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 126.008 1.723 . . . . 0.0 112.695 171.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -60.82 -40.43 92.71 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 122.871 0.468 . . . . 0.0 111.835 -177.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.725 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.1 mm? -59.01 -51.11 71.47 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.12 0.968 . . . . 0.0 111.101 171.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -62.93 -31.76 72.91 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.29 -52.01 67.08 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.58 0.752 . . . . 0.0 112.372 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.725 ' HE1' HD13 ' A' ' 40' ' ' LEU . 10.6 p-90 -73.29 -30.97 63.77 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 172.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.413 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -59.13 -31.76 46.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.072 1.349 . . . . 0.0 112.596 174.023 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -57.83 -21.41 42.23 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 118.717 0.689 . . . . 0.0 112.716 174.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.38 -16.99 22.97 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.35 1.06 . . . . 0.0 112.941 178.3 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.647 HD11 ' CH2' ' A' ' 43' ' ' TRP . 22.8 mt . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 178.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.9 tmm? -64.31 -51.74 61.97 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 123.982 0.913 . . . . 0.0 112.537 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 23.5 mttm -54.49 -34.99 62.63 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.22 -51.55 30.0 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.943 0.792 . . . . 0.0 111.722 178.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.8 -50.06 75.38 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.093 0.957 . . . . 0.0 110.832 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.07 -51.08 70.69 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.151 1.38 . . . . 0.0 112.133 178.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.8 -50.39 72.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 120.166 1.348 . . . . 0.0 112.555 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.67 -50.73 71.31 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.705 0.802 . . . . 0.0 112.475 178.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.1 tp -55.07 -49.65 71.11 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.213 1.405 . . . . 0.0 111.258 175.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.78 -44.16 97.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.825 1.25 . . . . 0.0 111.592 178.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.0 tttp -57.52 -50.22 73.8 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.773 1.17 . . . . 0.0 111.983 175.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.31 -49.7 74.59 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.662 0.785 . . . . 0.0 112.751 176.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.4 m80 -54.76 -50.84 67.44 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.635 0.774 . . . . 0.0 111.572 173.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -53.7 -47.92 70.04 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.836 1.654 . . . . 0.0 112.887 176.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.17 -48.43 73.77 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.014 0.926 . . . . 0.0 112.122 174.113 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.04 77.78 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 50.3 t -69.6 -26.03 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 126.167 1.787 . . . . 0.0 112.365 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.22 -31.78 44.92 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 173.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.3 pttt -93.2 -1.19 56.49 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 176.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -90.85 -81.37 0.31 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.425 1.09 . . . . 0.0 110.711 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.64 153.71 80.79 Favored Pre-proline 0 N--CA 1.481 1.078 0 C-N-CA 126.96 2.104 . . . . 0.0 113.273 -173.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.59 -48.24 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.828 3.018 . . . . 0.0 113.191 -178.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -66.73 -34.41 77.77 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.284 1.034 . . . . 0.0 112.389 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.71 -34.62 78.62 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.568 0.747 . . . . 0.0 111.921 178.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.33 -53.31 52.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 118.996 0.816 . . . . 0.0 109.837 170.034 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.1 mttt -59.84 -47.39 85.91 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.358 0.663 . . . . 0.0 111.053 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.63 -54.46 46.22 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.431 1.092 . . . . 0.0 113.43 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.41 -35.73 79.86 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.2 -0.937 . . . . 0.0 112.488 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.45 -45.78 71.57 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 121.473 -0.767 . . . . 0.0 110.941 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -52.62 -51.96 57.63 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.193 0.997 . . . . 0.0 111.261 168.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 7.0 tp -58.65 -37.18 75.41 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 119.286 0.948 . . . . 0.0 112.042 177.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.7 t -70.18 -48.23 58.11 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.066 -1.021 . . . . 0.0 112.581 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 ptpt -69.5 -36.28 76.33 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.789 0.836 . . . . 0.0 111.671 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.2 tp -72.34 -32.04 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 118.629 0.649 . . . . 0.0 111.77 176.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.27 -21.54 65.29 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 -177.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.886 0 C-N-CA 125.708 1.603 . . . . 0.0 113.236 176.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.559 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.041 0 CA-C-O 121.775 0.797 . . . . 0.0 112.884 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.91 -35.35 6.36 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.35 1.06 . . . . 0.0 112.738 174.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.8 pttt -57.35 -53.48 57.63 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.356 1.462 . . . . 0.0 112.494 171.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.559 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -69.03 -33.77 74.15 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 120.294 1.406 . . . . 0.0 111.895 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -59.09 -54.7 44.07 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 173.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.0 pttm -59.38 -42.77 92.45 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.529 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.5 mm -55.72 -48.52 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.325 1.05 . . . . 0.0 111.256 175.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -62.3 -45.35 93.66 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.237 1.381 . . . . 0.0 112.609 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.22 -35.47 81.16 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.584 0.754 . . . . 0.0 112.525 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.3 pt -79.31 -36.29 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 118.737 0.699 . . . . 0.0 112.208 170.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 55.6 t80 . . . . . 0 N--CA 1.473 0.701 0 C-N-CA 125.278 1.431 . . . . 0.0 112.024 179.281 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo . . . . . 0 CA--C 1.534 0.481 0 CA-C-O 121.093 0.372 . . . . 0.0 111.688 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -58.47 -25.54 62.39 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.608 -0.682 . . . . 0.0 112.801 175.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.7 m -61.56 -51.61 67.87 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.38 1.445 . . . . 0.0 112.197 177.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 9.4 p -75.3 -38.77 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.752 -0.593 . . . . 0.0 111.793 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -57.69 -48.33 79.83 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 118.911 0.778 . . . . 0.0 111.999 172.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.68 -39.55 73.47 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.511 1.05 . . . . 0.0 112.806 178.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -66.31 -34.81 78.83 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.675 1.125 . . . . 0.0 112.442 177.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.65 -21.55 25.22 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.108 0.963 . . . . 0.0 113.219 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 . . . . . 0 N--CA 1.48 1.051 0 C-N-CA 125.657 1.583 . . . . 0.0 113.864 179.184 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo . . . . . 0 CA--C 1.543 0.975 0 CA-C-O 119.165 -0.431 . . . . 0.0 111.731 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.25 -21.98 26.13 Favored 'Trans proline' 0 CA--C 1.554 1.478 0 C-N-CA 122.171 1.914 . . . . 0.0 116.5 167.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -70.28 166.53 27.92 Favored 'Trans proline' 0 C--N 1.362 1.268 0 CA-C-N 124.25 2.554 . . . . 0.0 112.873 178.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.31 126.86 19.49 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.814 2.343 . . . . 0.0 110.418 173.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -60.31 -33.81 72.9 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 119.807 -0.757 . . . . 0.0 111.419 174.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.458 HD23 ' H ' ' A' ' 10' ' ' LEU . 1.6 pt? -77.91 17.26 0.6 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.33 2.252 . . . . 0.0 115.902 172.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -38.49 105.37 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.029 1.731 . . . . 0.0 114.922 -173.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 147.69 24.17 0.08 OUTLIER Glycine 0 CA--C 1.539 1.581 0 C-N-CA 124.864 1.221 . . . . 0.0 115.296 -172.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.96 158.97 46.53 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 125.098 1.359 . . . . 0.0 112.542 -173.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.415 ' O ' HG23 ' A' ' 18' ' ' VAL . 88.5 Cg_endo -73.46 167.29 27.67 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.196 2.598 . . . . 0.0 112.755 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -50.99 -40.7 58.57 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.503 1.521 . . . . 0.0 113.264 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -56.93 -37.48 71.55 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.48 1.512 . . . . 0.0 113.058 176.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.0 t -81.77 -41.11 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 125.0 1.32 . . . . 0.0 111.634 174.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 14' ' ' PRO . 39.6 t -57.5 -36.94 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 123.956 0.902 . . . . 0.0 111.34 178.166 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.5 tptt -64.03 -43.22 96.26 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 172.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.77 -45.42 94.4 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.347 0.659 . . . . 0.0 110.54 175.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.76 -46.29 84.75 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-O 117.475 -1.25 . . . . 0.0 113.646 171.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.56 -47.02 83.26 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 120.192 1.36 . . . . 0.0 112.739 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.34 -38.25 88.78 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.02 0.928 . . . . 0.0 111.621 177.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.0 tp -63.89 -46.97 82.5 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 122.898 0.479 . . . . 0.0 111.46 171.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.44 -45.76 92.5 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.117 1.367 . . . . 0.0 114.443 -178.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -58.41 -28.26 65.05 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.664 1.12 . . . . 0.0 113.608 175.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -76.28 -32.61 58.9 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.503 1.521 . . . . 0.0 113.59 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -108.08 19.6 19.77 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.368 1.467 . . . . 0.0 114.197 176.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -57.79 -28.79 64.32 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 119.948 -1.72 . . . . 0.0 113.247 -177.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.7 m -77.18 -2.27 33.62 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.379 1.872 . . . . 0.0 113.767 179.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -83.21 167.28 17.85 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.381 1.472 . . . . 0.0 112.613 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.0 172.78 9.31 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 126.556 1.942 . . . . 0.0 112.213 177.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -50.77 -59.89 6.55 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 126.159 1.784 . . . . 0.0 112.913 175.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.8 -32.65 29.17 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.636 1.558 . . . . 0.0 112.974 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.65 -49.98 71.09 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.05 -1.032 . . . . 0.0 112.517 177.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 94.1 mt -61.93 -53.53 46.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 123.215 0.606 . . . . 0.0 110.228 174.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -58.52 -40.36 82.7 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 118.319 0.509 . . . . 0.0 112.342 -174.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.31 -54.22 49.22 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.412 1.885 . . . . 0.0 112.479 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.96 -41.12 97.63 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.738 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.9 mm? -59.36 -51.07 71.48 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 124.007 0.923 . . . . 0.0 113.033 171.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.61 -36.06 79.65 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 176.264 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.52 -50.33 73.42 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.159 0.89 . . . . 0.0 112.231 -177.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.738 ' HE1' HD13 ' A' ' 40' ' ' LEU 0.268 8.5 p-90 -69.24 -36.99 77.74 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 170.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.425 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -58.2 -31.19 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 125.109 1.364 . . . . 0.0 113.62 176.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -57.24 -17.66 12.6 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 175.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.35 -15.47 20.71 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.178 1.391 . . . . 0.0 113.689 176.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.677 HD11 ' CH2' ' A' ' 43' ' ' TRP . 32.6 mt . . . . . 0 N--CA 1.474 0.76 0 CA-C-N 118.899 0.772 . . . . 0.0 112.869 175.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.471 0.61 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -65.03 -51.57 60.82 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.608 1.163 . . . . 0.0 112.348 177.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 22.0 mtmt -54.97 -34.06 62.98 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.994 0.815 . . . . 0.0 112.668 172.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.39 -48.31 50.7 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 119.693 1.133 . . . . 0.0 111.767 178.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.45 -52.27 65.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.013 0.925 . . . . 0.0 110.66 177.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.01 -49.89 76.18 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.873 1.269 . . . . 0.0 112.259 178.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.1 -45.45 94.65 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.339 0.972 . . . . 0.0 112.014 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -63.43 -49.78 72.36 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 118.762 0.71 . . . . 0.0 111.674 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.8 mt -56.27 -50.02 72.55 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.045 1.338 . . . . 0.0 111.36 174.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -64.08 -41.68 97.22 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 118.569 -0.729 . . . . 0.0 112.249 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -59.2 -50.61 73.35 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.792 1.178 . . . . 0.0 111.719 176.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.79 -50.07 73.82 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.119 0.967 . . . . 0.0 113.091 175.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -57.05 -52.31 65.78 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 118.716 -0.659 . . . . 0.0 111.515 174.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -55.12 -44.16 74.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.537 1.535 . . . . 0.0 112.908 177.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.59 -52.32 64.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.246 1.019 . . . . 0.0 112.709 172.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.2 -33.34 75.17 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.534 0.606 . . . . 0.0 112.505 177.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 56.0 t -72.65 -25.46 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.242 1.817 . . . . 0.0 112.301 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.45 -33.02 58.78 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 175.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.4 pttt -90.25 -0.69 57.74 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.511 1.524 . . . . 0.0 114.289 173.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 tpp -95.26 -159.22 0.7 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.612 1.965 . . . . 0.0 111.89 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.38 156.84 20.09 Favored Pre-proline 0 N--CA 1.478 0.953 0 C-N-CA 126.313 1.845 . . . . 0.0 114.334 176.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -71.75 -43.04 1.42 Allowed 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.85 3.034 . . . . 0.0 113.537 -175.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -58.98 -36.59 75.13 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.668 1.187 . . . . 0.0 111.765 174.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.86 -42.47 90.38 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.488 0.715 . . . . 0.0 110.321 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.91 -46.45 71.44 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.302 1.041 . . . . 0.0 111.799 173.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -62.97 -51.95 64.88 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.509 1.123 . . . . 0.0 112.083 178.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.07 -55.66 30.22 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.47 0.708 . . . . 0.0 112.02 176.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.75 -31.17 71.64 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.98 77.1 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.751 1.16 . . . . 0.0 111.275 171.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -42.59 94.63 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 174.428 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.412 ' HA ' HG22 ' A' ' 94' ' ' ILE . 3.4 mm? -63.97 -39.41 94.06 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 118.979 0.808 . . . . 0.0 113.121 174.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.0 t -71.6 -39.59 70.42 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 120.952 -1.092 . . . . 0.0 111.856 -177.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.04 -37.57 64.26 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 118.831 -0.604 . . . . 0.0 112.17 176.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.412 HG22 ' HA ' ' A' ' 91' ' ' LEU . 10.4 tt -72.99 -32.25 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 119.133 0.879 . . . . 0.0 112.972 177.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.78 -22.69 64.35 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 . . . . . 0 CA--C 1.551 1.017 0 C-N-CA 125.142 1.377 . . . . 0.0 113.613 173.268 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.471 0.59 0 CA-C-O 121.044 0.449 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -55.66 -37.62 68.5 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.775 1.23 . . . . 0.0 113.009 -174.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -61.25 -58.7 7.23 Favored 'General case' 0 C--N 1.346 0.45 0 C-N-CA 124.627 1.171 . . . . 0.0 112.428 170.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.96 77.62 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.057 1.343 . . . . 0.0 113.312 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -56.6 -52.19 65.8 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.091 1.356 . . . . 0.0 111.527 168.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.88 -48.04 64.26 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 118.791 -0.624 . . . . 0.0 111.675 173.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.1 mm -58.31 -52.22 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 118.849 0.749 . . . . 0.0 111.407 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -63.57 -36.98 85.58 Favored 'General case' 0 C--O 1.242 0.683 0 O-C-N 121.501 -0.749 . . . . 0.0 112.782 178.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.64 -41.54 83.69 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.312 -1.328 . . . . 0.0 113.016 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.4 pt -75.14 -33.31 28.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 O-C-N 121.464 -0.773 . . . . 0.0 110.95 177.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.3 t80 . . . . . 0 CA--C 1.534 0.33 0 O-C-N 121.235 -0.915 . . . . 0.0 111.598 176.675 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo . . . . . 0 CA--C 1.535 0.558 0 CA-C-O 121.975 0.74 . . . . 0.0 112.608 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -22.04 66.86 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.539 -0.726 . . . . 0.0 112.523 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 49.9 m -64.91 -48.62 73.51 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 173.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.1 p -74.88 -37.16 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 119.002 0.819 . . . . 0.0 110.485 177.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -57.6 -50.41 73.22 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.963 0.801 . . . . 0.0 111.991 171.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -63.23 -44.0 96.51 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.49 1.041 . . . . 0.0 112.996 178.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -66.59 -32.83 74.41 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.482 -0.761 . . . . 0.0 112.714 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.92 -22.79 21.81 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.192 0.997 . . . . 0.0 113.682 178.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 . . . . . 0 N--CA 1.475 0.8 0 C-N-CA 125.719 1.608 . . . . 0.0 111.953 176.245 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo . . . . . 0 CA--C 1.545 1.035 0 CA-C-O 119.118 -0.451 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -70.39 -23.47 27.89 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 CA-C-O 115.292 -2.045 . . . . 0.0 115.927 164.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -72.3 167.72 26.14 Favored 'Trans proline' 0 C--N 1.362 1.282 0 CA-C-N 124.596 2.677 . . . . 0.0 113.017 179.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -63.35 127.2 19.42 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.991 2.461 . . . . 0.0 112.053 177.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -62.32 -14.78 43.03 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 172.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.432 ' N ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -118.96 36.01 4.61 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 129.029 2.932 . . . . 0.0 112.409 177.236 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.89 109.82 0.19 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.682 1.593 . . . . 0.0 113.123 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.23 -19.4 1.37 Allowed Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.749 1.643 . . . . 0.0 114.069 -176.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.9 160.9 81.37 Favored Pre-proline 0 CA--C 1.558 1.276 0 C-N-CA 125.646 1.578 . . . . 0.0 113.753 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -75.68 171.54 18.0 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.921 3.081 . . . . 0.0 113.669 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -53.38 -35.17 60.04 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.619 1.168 . . . . 0.0 113.944 -178.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -54.35 -42.1 69.87 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.51 1.524 . . . . 0.0 112.068 174.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -77.81 -43.0 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 125.355 1.462 . . . . 0.0 112.099 173.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 88.3 t -55.29 -36.82 41.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 118.806 0.73 . . . . 0.0 111.352 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.7 tptm -62.96 -50.49 70.58 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.987 -1.071 . . . . 0.0 112.24 172.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.03 -48.34 73.54 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.467 0.707 . . . . 0.0 111.798 177.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -53.58 -52.42 59.81 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.738 1.215 . . . . 0.0 112.149 171.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -60.04 -47.51 85.56 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.571 1.078 . . . . 0.0 113.076 -179.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -63.71 -36.34 83.55 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.676 0.79 . . . . 0.0 111.732 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.7 tp -66.25 -46.06 78.41 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.372 0.669 . . . . 0.0 111.829 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -63.49 -45.97 88.29 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.843 1.257 . . . . 0.0 114.024 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -33.53 70.92 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 120.048 1.295 . . . . 0.0 113.461 177.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -69.1 -33.41 73.46 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.396 1.878 . . . . 0.0 112.95 173.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -107.04 20.34 19.17 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.019 2.128 . . . . 0.0 112.895 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -64.4 -25.51 68.05 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 119.775 -1.828 . . . . 0.0 112.762 -174.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.3 -5.01 59.0 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 127.142 2.177 . . . . 0.0 113.335 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.2 mmtt -76.09 -177.71 4.07 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.332 1.453 . . . . 0.0 112.906 178.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.77 172.77 6.67 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 128.082 2.553 . . . . 0.0 111.705 -177.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -49.96 -59.83 6.23 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 125.28 1.432 . . . . 0.0 112.426 176.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.45 -32.91 18.89 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 121.613 1.542 . . . . 0.0 113.261 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.48 -48.06 81.25 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.063 -1.023 . . . . 0.0 111.955 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 54.2 mt -66.1 -52.27 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.278 0.631 . . . . 0.0 110.02 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -57.08 -41.12 78.26 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.69 0.677 . . . . 0.0 111.814 -177.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -52.35 65.98 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.294 1.438 . . . . 0.0 112.917 174.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -62.25 -42.47 99.35 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.638 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.0 mm? -60.1 -49.73 76.49 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.295 1.038 . . . . 0.0 110.979 173.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.8 -35.44 76.5 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 176.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.73 -49.36 76.81 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.447 -0.783 . . . . 0.0 112.339 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.638 ' HE1' HD13 ' A' ' 40' ' ' LEU . 9.9 p-90 -73.17 -32.94 65.15 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 172.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -58.39 -30.68 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 125.507 1.523 . . . . 0.0 112.987 174.274 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.84 -19.28 16.57 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 118.803 0.729 . . . . 0.0 112.907 174.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.27 -18.54 22.36 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.799 1.24 . . . . 0.0 113.795 175.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.61 HD11 ' CH2' ' A' ' 43' ' ' TRP . 33.0 mt . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 178.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.76 -51.5 66.9 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.653 1.181 . . . . 0.0 111.905 177.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.5 mtmm -57.86 -33.6 68.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.46 -50.15 34.44 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.037 0.835 . . . . 0.0 111.444 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 tttm -57.15 -49.73 75.02 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.654 0.782 . . . . 0.0 110.396 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -62.19 -52.0 65.53 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.72 1.208 . . . . 0.0 112.23 179.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.66 -46.27 90.47 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.803 1.183 . . . . 0.0 112.859 178.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -61.75 -50.16 73.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.527 1.131 . . . . 0.0 111.398 178.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tt -56.7 -51.16 69.86 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.467 1.107 . . . . 0.0 110.685 174.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.38 -40.86 97.85 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.982 -178.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.1 tttt -59.01 -50.86 72.5 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.384 0.993 . . . . 0.0 111.379 173.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.33 -44.87 86.43 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.268 0.556 . . . . 0.0 111.548 -176.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -60.53 -49.36 77.86 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.798 1.239 . . . . 0.0 110.94 175.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.03 -43.21 86.65 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.647 1.112 . . . . 0.0 112.843 175.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -55.14 -52.57 62.86 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.43 1.092 . . . . 0.0 112.445 173.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.51 -31.27 71.89 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 175.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.4 t -73.05 -23.76 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.678 1.591 . . . . 0.0 113.382 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.63 -30.77 67.54 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.695 1.369 . . . . 0.0 114.695 177.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -86.09 -2.65 58.52 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.516 1.526 . . . . 0.0 114.219 172.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.9 tpp -96.86 -160.41 0.8 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.407 1.883 . . . . 0.0 111.833 -174.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.89 156.64 18.14 Favored Pre-proline 0 N--CA 1.478 0.971 0 C-N-CA 126.735 2.014 . . . . 0.0 113.984 174.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.79 -48.32 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 123.599 2.866 . . . . 0.0 112.858 -176.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -57.13 -32.96 66.89 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.034 1.334 . . . . 0.0 112.269 177.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.22 -48.79 74.49 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.474 0.709 . . . . 0.0 110.596 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -54.87 -45.5 74.62 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.713 0.688 . . . . 0.0 111.235 173.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? -54.99 -54.91 36.86 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 118.867 0.758 . . . . 0.0 111.241 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.54 -51.93 67.74 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.956 0.903 . . . . 0.0 113.15 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.4 -40.5 95.93 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -178.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.19 -45.11 94.84 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.481 0.712 . . . . 0.0 110.93 174.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -43.88 90.67 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.399 0.545 . . . . 0.0 112.374 172.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.63 -36.96 84.5 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 174.439 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 10.3 t -70.67 -42.41 70.77 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.406 1.082 . . . . 0.0 112.987 -178.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -70.5 -44.01 68.51 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.521 -0.737 . . . . 0.0 111.133 175.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.8 tt -68.26 -30.63 48.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 118.697 0.681 . . . . 0.0 112.371 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.06 -33.69 69.31 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 176.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 . . . . . 0 CA--C 1.542 0.648 0 C-N-CA 124.087 0.955 . . . . 0.0 113.412 173.291 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.535 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -44.94 -38.45 4.69 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.761 1.224 . . . . 0.0 112.994 172.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -63.99 -59.38 4.56 Favored 'General case' 0 C--N 1.345 0.394 0 C-N-CA 123.571 0.748 . . . . 0.0 111.031 174.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.535 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -63.16 -33.32 75.22 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.994 0.816 . . . . 0.0 113.071 -178.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.74 -53.73 53.04 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.688 1.595 . . . . 0.0 110.805 168.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -58.12 -48.12 81.19 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.044 0.937 . . . . 0.0 112.527 175.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 26.9 mm -54.05 -52.05 40.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.666 0.786 . . . . 0.0 110.562 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -66.62 -40.97 89.01 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 118.688 -0.672 . . . . 0.0 112.392 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.82 -40.36 94.99 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.566 1.075 . . . . 0.0 111.122 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 53.3 mt -75.86 -51.76 19.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 C-N-CA 123.983 0.913 . . . . 0.0 110.978 176.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.7 t80 . . . . . 0 N--CA 1.47 0.568 0 CA-C-N 118.879 0.763 . . . . 0.0 112.726 179.4 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo . . . . . 0 CA--C 1.537 0.643 0 CA-C-O 121.966 0.736 . . . . 0.0 113.01 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.04 -24.49 67.73 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.242 -0.911 . . . . 0.0 112.784 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.5 m -60.94 -51.54 68.85 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.248 0.931 . . . . 0.0 112.145 173.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.57 -37.34 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-N 118.529 0.604 . . . . 0.0 111.573 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.2 mtmp? -58.01 -49.89 75.31 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.794 -0.622 . . . . 0.0 111.972 172.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -64.33 -45.08 89.42 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.091 0.86 . . . . 0.0 112.891 177.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -65.63 -32.03 73.38 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.692 0.678 . . . . 0.0 112.744 -179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.19 -21.57 21.07 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 178.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 . . . . . 0 N--CA 1.475 0.784 0 C-N-CA 124.875 1.27 . . . . 0.0 112.521 179.238 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo . . . . . 0 CA--C 1.548 1.193 0 CA-C-O 118.965 -0.514 . . . . 0.0 111.663 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -71.65 -19.78 27.51 Favored 'Trans proline' 0 CA--C 1.554 1.486 0 C-N-CA 122.099 1.866 . . . . 0.0 116.11 164.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.48 169.43 20.93 Favored 'Trans proline' 0 C--N 1.362 1.281 0 CA-C-N 124.272 2.561 . . . . 0.0 112.729 177.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -60.1 122.31 11.18 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.858 2.372 . . . . 0.0 110.75 171.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -53.4 -32.62 50.38 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.054 0.542 . . . . 0.0 111.949 172.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.561 ' H ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -103.12 38.9 1.66 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 128.312 2.645 . . . . 0.0 113.138 176.859 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.72 112.92 0.48 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.808 1.243 . . . . 0.0 113.296 176.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.5 11.06 0.32 Allowed Glycine 0 CA--C 1.538 1.474 0 C-N-CA 125.296 1.427 . . . . 0.0 115.634 -176.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -111.27 159.8 31.55 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 125.645 1.578 . . . . 0.0 112.846 -171.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -73.53 169.74 21.6 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.298 2.665 . . . . 0.0 113.085 178.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -52.53 -35.19 52.83 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.553 1.141 . . . . 0.0 113.659 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -56.38 -39.07 72.34 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.205 1.402 . . . . 0.0 112.802 174.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.404 HG13 ' HH2' ' A' ' 43' ' ' TRP . 54.5 t -77.91 -44.83 28.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.595 1.158 . . . . 0.0 111.792 171.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 94.2 t -54.22 -37.53 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 123.366 0.667 . . . . 0.0 111.468 -178.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.7 tppt? -59.91 -50.57 73.25 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.363 -0.836 . . . . 0.0 112.376 174.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.95 -47.97 83.17 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.044 0.938 . . . . 0.0 111.728 177.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.464 ' CD1' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -53.79 -53.67 49.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.665 0.786 . . . . 0.0 111.433 172.609 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -63.19 -45.1 93.31 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.445 1.02 . . . . 0.0 113.138 -179.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -59.74 -39.17 83.88 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.231 1.013 . . . . 0.0 111.555 177.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.492 HD23 HD22 ' A' ' 40' ' ' LEU . 12.9 tp -68.31 -45.8 71.99 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.148 0.579 . . . . 0.0 111.577 172.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.548 HD12 HD21 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -64.2 -45.73 87.0 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 179.759 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -56.88 -31.62 65.03 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 119.649 1.113 . . . . 0.0 112.431 178.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -73.65 -29.34 62.27 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.025 1.33 . . . . 0.0 111.744 175.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -109.81 23.7 14.03 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.045 1.738 . . . . 0.0 112.549 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -22.09 66.57 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 119.904 -1.747 . . . . 0.0 113.687 -175.502 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.0 p -92.88 4.11 54.48 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 128.803 2.841 . . . . 0.0 114.307 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -85.75 179.9 6.97 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.329 1.452 . . . . 0.0 111.858 178.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.22 171.27 7.71 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.284 2.234 . . . . 0.0 111.562 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -52.13 -57.62 14.51 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 124.625 1.17 . . . . 0.0 112.338 176.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.9 -33.19 27.16 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.516 1.477 . . . . 0.0 113.319 178.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.23 -47.14 80.83 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.166 -0.959 . . . . 0.0 112.603 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.4 mt -68.44 -53.28 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.089 0.556 . . . . 0.0 109.651 175.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -56.93 -35.84 69.52 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 119.023 -0.513 . . . . 0.0 112.068 -175.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 34.7 tttt -56.97 -58.32 8.66 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.194 1.798 . . . . 0.0 113.434 172.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -59.06 -40.06 84.0 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 122.962 0.505 . . . . 0.0 111.084 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.803 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.1 mm? -60.26 -50.33 74.08 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.369 1.068 . . . . 0.0 111.253 173.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.56 -33.25 71.19 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.62 -51.86 68.14 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.603 -0.686 . . . . 0.0 112.213 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.803 ' HE1' HD13 ' A' ' 40' ' ' LEU . 13.4 p-90 -73.8 -30.77 62.92 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 172.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.452 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -60.11 -32.15 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 O-C-N 120.781 -1.2 . . . . 0.0 112.677 174.427 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -58.0 -19.24 29.46 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 118.565 0.62 . . . . 0.0 112.268 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.89 -14.89 21.49 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.878 1.271 . . . . 0.0 113.222 177.273 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.643 HD11 ' CH2' ' A' ' 43' ' ' TRP . 22.8 mt . . . . . 0 N--CA 1.474 0.744 0 CA-C-N 118.99 0.814 . . . . 0.0 112.528 175.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -63.98 -51.9 62.15 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 124.183 0.993 . . . . 0.0 112.298 178.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -52.83 -39.12 62.2 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.329 173.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.08 -51.42 54.67 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.023 0.829 . . . . 0.0 111.885 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.4 mttm -58.87 -51.67 69.01 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.013 0.925 . . . . 0.0 111.272 175.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.22 -52.63 64.78 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.809 1.244 . . . . 0.0 111.963 177.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.83 -52.75 63.87 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.827 1.194 . . . . 0.0 112.863 178.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -62.85 -48.99 76.64 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.323 0.649 . . . . 0.0 112.314 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tp -54.84 -49.66 70.52 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.964 1.306 . . . . 0.0 111.171 174.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.22 -43.6 98.62 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.515 1.126 . . . . 0.0 111.729 178.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -58.25 -50.76 72.42 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.588 1.085 . . . . 0.0 111.954 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.96 -48.5 78.63 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.539 1.136 . . . . 0.0 112.633 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -57.3 -54.24 49.08 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.879 0.872 . . . . 0.0 110.979 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -40.99 72.87 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.998 1.319 . . . . 0.0 113.041 177.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.02 -52.63 64.71 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.479 0.712 . . . . 0.0 112.424 172.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.04 -31.49 72.05 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 176.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 62.8 t -73.04 -23.84 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 126.016 1.726 . . . . 0.0 112.63 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.78 -32.66 63.66 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.684 -1.26 . . . . 0.0 114.159 176.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -87.92 0.45 55.85 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.527 1.531 . . . . 0.0 114.551 174.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.3 mmt -94.57 -159.82 0.73 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.734 1.614 . . . . 0.0 111.254 -178.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.8 156.43 6.66 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.209 2.203 . . . . 0.0 114.038 173.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -69.38 -45.49 1.77 Allowed 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 123.692 2.928 . . . . 0.0 112.726 -176.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -59.67 -31.32 69.44 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.143 0.977 . . . . 0.0 112.223 176.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -66.03 -49.23 68.46 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.191 0.596 . . . . 0.0 110.283 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.02 -46.88 61.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.891 0.877 . . . . 0.0 110.714 172.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -58.93 -54.91 41.85 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.734 0.814 . . . . 0.0 111.162 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.69 -47.84 84.47 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.541 0.736 . . . . 0.0 112.75 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.85 -40.05 83.73 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.08 -45.74 92.19 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 119.455 1.025 . . . . 0.0 110.742 174.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.62 -44.05 89.86 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.117 0.967 . . . . 0.0 112.219 173.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.8 tp -63.96 -36.66 84.71 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 121.576 -0.703 . . . . 0.0 112.539 171.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.7 t -72.28 -39.35 68.39 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 120.357 -1.464 . . . . 0.0 112.899 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -71.16 -43.51 67.36 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.732 0.813 . . . . 0.0 110.989 175.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 7.3 tt -70.17 -32.13 49.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 118.588 0.631 . . . . 0.0 112.446 178.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.18 -30.21 64.32 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 CA--C 1.549 0.927 0 C-N-CA 125.256 1.422 . . . . 0.0 114.526 177.572 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.07 -38.98 8.63 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.688 1.595 . . . . 0.0 113.101 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.78 -59.5 5.33 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.314 173.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -63.74 -33.69 76.22 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.735 0.698 . . . . 0.0 111.7 -176.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -60.14 -47.91 83.93 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.288 1.035 . . . . 0.0 111.817 173.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -46.35 91.08 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 118.403 -0.808 . . . . 0.0 111.665 174.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 24.9 mm -53.19 -49.81 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 125.123 1.369 . . . . 0.0 111.194 174.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -63.31 -44.17 95.71 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.98 1.264 . . . . 0.0 112.603 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.24 -49.03 79.23 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 122.707 0.403 . . . . 0.0 111.151 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.4 pp -70.99 -31.98 46.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 118.289 -0.863 . . . . 0.0 112.497 174.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 79.3 t80 . . . . . 0 N--CA 1.471 0.614 0 CA-C-N 120.345 1.43 . . . . 0.0 111.904 178.154 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo . . . . . 0 CA--C 1.535 0.546 0 CA-C-O 121.143 0.393 . . . . 0.0 111.684 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -62.79 -22.5 66.66 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 176.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.9 m -62.61 -51.64 66.52 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.911 1.232 . . . . 0.0 112.256 174.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 9.4 p -73.6 -38.81 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 O-C-N 121.755 -0.591 . . . . 0.0 111.163 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 29.6 mmtt -58.31 -49.29 77.69 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.53 -0.731 . . . . 0.0 111.922 174.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -66.68 -43.56 84.14 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.445 1.02 . . . . 0.0 113.024 177.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -64.98 -36.74 85.39 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.368 -0.832 . . . . 0.0 112.429 179.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.67 -22.03 26.34 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.288 1.035 . . . . 0.0 113.128 179.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 . . . . . 0 N--CA 1.476 0.858 0 C-N-CA 125.703 1.601 . . . . 0.0 112.132 179.27 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 CA--C 1.547 1.125 0 CA-C-O 119.136 -0.443 . . . . 0.0 111.88 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -71.23 -23.58 24.22 Favored 'Trans proline' 0 CA--C 1.554 1.476 0 C-N-CA 122.32 2.013 . . . . 0.0 116.888 167.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -71.97 168.91 22.62 Favored 'Trans proline' 0 C--N 1.361 1.232 0 CA-C-N 124.26 2.557 . . . . 0.0 113.156 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -61.93 130.08 29.72 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.831 2.354 . . . . 0.0 110.988 173.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -55.04 -42.53 72.77 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.922 0.868 . . . . 0.0 111.632 174.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.545 HD23 ' H ' ' A' ' 10' ' ' LEU . 2.2 pt? -78.73 17.02 0.75 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 127.991 2.516 . . . . 0.0 115.363 177.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -33.25 103.61 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 127.24 2.216 . . . . 0.0 115.325 -173.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.45 32.87 0.11 Allowed Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.095 1.331 . . . . 0.0 114.548 -172.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -125.23 157.79 66.12 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 125.621 1.568 . . . . 0.0 112.021 -175.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -74.44 169.08 23.32 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.065 2.51 . . . . 0.0 113.053 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -53.55 -37.29 62.74 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.65 1.18 . . . . 0.0 113.465 -177.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -57.27 -37.68 72.74 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.278 1.431 . . . . 0.0 112.671 176.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.0 t -82.65 -38.2 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.401 1.481 . . . . 0.0 112.194 174.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.1 t -57.56 -39.33 68.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.936 0.894 . . . . 0.0 110.742 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.5 tptm -61.13 -50.58 72.61 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.653 -1.28 . . . . 0.0 111.799 173.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -53.83 -47.27 71.09 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.237 0.615 . . . . 0.0 112.268 176.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -51.9 -52.97 46.11 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.388 1.075 . . . . 0.0 112.081 169.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -47.47 85.77 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.953 0.901 . . . . 0.0 113.331 -177.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.81 -38.89 92.79 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.422 0.689 . . . . 0.0 111.529 177.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 14.0 tp -63.71 -44.49 93.49 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 122.938 0.495 . . . . 0.0 111.969 172.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.58 -34.88 78.79 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.887 1.275 . . . . 0.0 113.871 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.9 mmtt -54.66 -32.95 59.97 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.844 1.202 . . . . 0.0 113.991 174.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.9 ttpp -69.1 -38.56 79.0 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.88 1.272 . . . . 0.0 112.715 172.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -104.17 14.35 30.6 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.709 1.604 . . . . 0.0 113.245 -172.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -22.3 41.58 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 120.33 -1.481 . . . . 0.0 114.694 -175.161 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.7 p -103.67 1.16 31.56 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 127.123 2.169 . . . . 0.0 114.847 179.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -76.81 170.65 16.08 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.39 1.476 . . . . 0.0 111.96 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.29 171.76 12.42 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.888 1.675 . . . . 0.0 111.915 175.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -50.97 -59.72 6.99 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 124.75 1.22 . . . . 0.0 112.218 174.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.547 ' HA ' ' HG3' ' A' ' 37' ' ' GLU . 59.2 Cg_endo -67.03 -28.86 41.11 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.296 1.997 . . . . 0.0 113.479 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -67.53 -50.05 60.51 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.064 -1.648 . . . . 0.0 112.586 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.7 mt -62.97 -53.4 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 CA-C-N 118.662 0.665 . . . . 0.0 110.022 176.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.547 ' HG3' ' HA ' ' A' ' 34' ' ' PRO . 2.0 pp20? -55.33 -42.33 73.65 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 117.866 -1.064 . . . . 0.0 111.244 -177.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -57.56 -51.39 69.69 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-N 119.672 1.124 . . . . 0.0 112.066 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -40.74 96.63 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.725 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.2 mm? -61.13 -51.12 70.41 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.687 0.795 . . . . 0.0 111.789 172.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.85 -30.45 71.51 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.149 -0.97 . . . . 0.0 113.106 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.16 -49.05 78.8 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.129 -0.982 . . . . 0.0 112.346 178.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.725 ' HE1' HD13 ' A' ' 40' ' ' LEU . 10.8 p-90 -73.72 -35.52 65.11 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 173.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.618 HG23 HD12 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -59.65 -30.68 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 124.898 1.279 . . . . 0.0 112.401 176.813 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -57.27 -14.51 4.48 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.909 0.884 . . . . 0.0 112.912 174.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.79 -12.11 16.0 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.645 1.578 . . . . 0.0 113.833 176.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.678 HD11 ' CH2' ' A' ' 43' ' ' TRP . 17.5 mt . . . . . 0 N--CA 1.474 0.766 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 176.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -61.08 -53.5 56.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.829 1.252 . . . . 0.0 111.989 178.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.9 mtmt -60.14 -31.89 70.51 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 119.032 -0.509 . . . . 0.0 112.344 175.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.43 -51.47 23.74 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.837 0.744 . . . . 0.0 111.455 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -58.76 -49.29 78.19 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.744 0.817 . . . . 0.0 110.791 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -60.96 -52.27 65.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.773 1.229 . . . . 0.0 112.131 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.8 -44.7 96.35 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 119.797 1.18 . . . . 0.0 113.258 179.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -67.53 -45.08 76.77 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.456 0.703 . . . . 0.0 111.954 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.01 -51.23 70.1 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.119 0.967 . . . . 0.0 110.949 170.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.4 -42.93 99.52 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.057 -179.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -56.31 -50.76 70.53 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.558 1.072 . . . . 0.0 111.965 173.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.55 82.05 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -60.65 -49.44 77.51 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.049 0.94 . . . . 0.0 111.046 176.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.63 -42.64 83.79 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.086 1.354 . . . . 0.0 112.993 175.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -56.25 -52.59 63.91 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.324 1.05 . . . . 0.0 112.171 172.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.88 -31.52 72.17 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 177.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.1 t -73.06 -24.8 21.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 125.812 1.645 . . . . 0.0 113.086 176.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.65 -30.59 65.54 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 177.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.2 1.28 54.8 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.729 1.611 . . . . 0.0 114.406 172.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.3 ttm -103.53 -158.57 0.67 Allowed 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 126.429 1.891 . . . . 0.0 111.558 -172.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.76 156.11 36.65 Favored Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 125.179 1.391 . . . . 0.0 113.958 178.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.65 -43.86 1.21 Allowed 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 123.44 2.76 . . . . 0.0 113.084 -176.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -58.97 -34.3 71.65 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.329 1.052 . . . . 0.0 112.107 175.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.72 -43.59 88.61 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 122.998 0.519 . . . . 0.0 110.241 177.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -42.82 77.26 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.219 1.008 . . . . 0.0 112.056 173.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -59.83 -54.29 47.99 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.466 1.107 . . . . 0.0 111.563 175.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.43 -51.52 69.53 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.232 1.013 . . . . 0.0 113.085 178.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.6 -34.83 76.45 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 179.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.35 -51.67 68.95 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.46 1.027 . . . . 0.0 109.92 172.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -52.93 -51.96 59.5 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.808 0.843 . . . . 0.0 111.947 173.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.27 -37.86 84.65 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.7 t -72.98 -37.72 66.92 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.282 1.033 . . . . 0.0 112.541 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -38.86 56.73 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 121.706 -0.621 . . . . 0.0 111.694 177.35 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 12.0 tt -70.71 -31.62 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 119.148 0.886 . . . . 0.0 112.778 175.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.11 -33.38 67.28 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 . . . . . 0 CA--C 1.544 0.749 0 C-N-CA 124.147 0.979 . . . . 0.0 113.559 171.583 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -48.52 -38.93 21.58 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.411 1.085 . . . . 0.0 113.36 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -59.3 -59.35 5.6 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.845 0.858 . . . . 0.0 111.626 174.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.89 -33.38 75.69 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -177.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.59 -51.02 71.68 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.645 1.178 . . . . 0.0 110.53 171.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -52.75 -51.88 58.78 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 117.715 -1.136 . . . . 0.0 111.095 172.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 10.4 mm -53.68 -48.5 60.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.284 0.947 . . . . 0.0 111.582 177.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -65.08 -44.11 89.99 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.31 -0.869 . . . . 0.0 113.209 178.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.08 78.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.951 0.9 . . . . 0.0 112.126 177.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.49 -37.15 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 122.853 0.461 . . . . 0.0 111.891 175.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 70.1 t80 . . . . . 0 N--CA 1.47 0.574 0 CA-C-N 119.458 1.026 . . . . 0.0 112.194 176.689 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo . . . . . 0 CA--C 1.538 0.719 0 CA-C-O 121.802 0.667 . . . . 0.0 112.932 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -63.98 -24.89 67.89 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.547 -0.721 . . . . 0.0 112.865 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.9 t -61.22 -51.64 68.14 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.229 -0.919 . . . . 0.0 111.981 177.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.1 p -73.97 -38.12 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 121.737 -0.602 . . . . 0.0 112.051 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.47 -48.84 76.26 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.073 0.851 . . . . 0.0 111.706 171.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -67.93 -42.5 80.94 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.306 0.957 . . . . 0.0 112.96 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -65.99 -34.25 77.67 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.137 0.881 . . . . 0.0 112.592 177.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.08 -22.82 25.18 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 178.361 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 . . . . . 0 N--CA 1.477 0.882 0 C-N-CA 125.511 1.525 . . . . 0.0 113.011 179.882 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo . . . . . 0 CA--C 1.543 0.947 0 CA-C-O 119.413 -0.328 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -67.64 -24.77 41.14 Favored 'Trans proline' 0 CA--C 1.554 1.497 0 C-N-CA 122.669 2.246 . . . . 0.0 116.492 167.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.6 166.36 26.16 Favored 'Trans proline' 0 C--N 1.361 1.223 0 CA-C-N 124.093 2.497 . . . . 0.0 112.8 175.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 35.0 Cg_endo -59.15 131.3 40.54 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 123.099 2.533 . . . . 0.0 111.626 171.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -48.4 -47.22 37.87 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.415 0.686 . . . . 0.0 111.818 170.068 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.56 HD23 ' H ' ' A' ' 10' ' ' LEU . 1.8 pt? -83.47 18.06 1.96 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 126.6 1.96 . . . . 0.0 115.219 -178.577 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -32.92 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 127.018 2.127 . . . . 0.0 115.611 -172.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.09 27.71 0.17 Allowed Glycine 0 CA--C 1.537 1.453 0 C-N-CA 124.814 1.197 . . . . 0.0 114.448 -172.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.79 157.45 59.84 Favored Pre-proline 0 CA--C 1.552 1.036 0 C-N-CA 125.722 1.609 . . . . 0.0 111.663 -175.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -73.36 168.37 24.94 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.114 2.543 . . . . 0.0 112.923 -178.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -54.76 -38.24 66.97 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.532 1.133 . . . . 0.0 113.464 -177.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.76 -40.9 66.61 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.517 1.527 . . . . 0.0 112.428 173.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.1 t -80.69 -39.52 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 124.812 1.245 . . . . 0.0 111.683 176.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 59.5 t -56.28 -40.91 68.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.077 0.951 . . . . 0.0 111.105 177.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.7 tptm -61.28 -50.69 72.01 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 121.132 -0.98 . . . . 0.0 111.968 173.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -53.36 -47.58 69.29 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.531 0.733 . . . . 0.0 112.042 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.428 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -52.06 -53.79 38.02 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.676 1.191 . . . . 0.0 112.156 169.742 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.33 -47.61 84.77 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.27 0.941 . . . . 0.0 113.533 -178.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -68.61 -28.76 67.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.477 0.711 . . . . 0.0 112.295 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.3 tp -68.75 -48.53 63.51 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 121.56 -0.713 . . . . 0.0 111.668 165.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.71 -34.65 73.18 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.652 1.581 . . . . 0.0 113.905 -178.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -30.72 47.42 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.924 1.238 . . . . 0.0 113.099 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.4 -34.33 70.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.882 1.673 . . . . 0.0 112.372 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -109.85 16.84 21.73 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.952 2.101 . . . . 0.0 113.15 -175.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -20.59 56.65 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 119.974 -1.704 . . . . 0.0 114.529 -174.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.1 m -102.24 0.77 34.95 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.849 2.06 . . . . 0.0 113.086 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -74.33 175.96 7.15 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.23 1.412 . . . . 0.0 111.875 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.65 174.7 6.86 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.4 1.88 . . . . 0.0 111.902 175.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.78 -60.69 3.84 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 126.539 1.935 . . . . 0.0 112.774 172.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.85 -33.77 25.88 Favored 'Trans proline' 0 C--N 1.357 1.014 0 C-N-CA 121.881 1.721 . . . . 0.0 113.284 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -65.06 -46.16 82.32 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.118 -0.989 . . . . 0.0 112.224 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 66.7 mt -67.73 -53.29 32.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 122.931 0.493 . . . . 0.0 110.371 175.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -56.38 -38.33 71.3 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 118.403 0.547 . . . . 0.0 111.835 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -58.19 -57.17 14.02 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 125.227 1.411 . . . . 0.0 113.016 173.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -65.8 -35.47 80.79 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.756 0.312 . . . . 0.0 111.672 -175.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.779 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.7 mm? -64.54 -49.46 71.16 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.977 1.311 . . . . 0.0 111.732 170.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.26 -41.0 71.61 Favored 'General case' 0 N--CA 1.465 0.319 0 O-C-N 121.177 -0.952 . . . . 0.0 113.303 174.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.64 -48.7 71.95 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -175.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.779 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.1 p-90 -72.92 -36.01 67.16 Favored 'General case' 0 CA--C 1.554 1.119 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 168.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -32.85 39.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 125.258 1.423 . . . . 0.0 112.364 175.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -60.1 -15.63 25.04 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.827 0.851 . . . . 0.0 112.762 177.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 21.5 m -100.88 -17.99 16.58 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.414 1.486 . . . . 0.0 112.614 176.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.69 HD11 ' CH2' ' A' ' 43' ' ' TRP . 17.8 mt . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 178.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -51.93 64.02 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 124.866 1.266 . . . . 0.0 112.502 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -55.68 -38.65 69.92 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.918 0.887 . . . . 0.0 111.038 172.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.64 -46.92 67.92 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 123.117 0.567 . . . . 0.0 111.884 -178.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -59.57 -53.26 60.16 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.249 1.02 . . . . 0.0 111.581 175.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.2 -38.27 89.94 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.71 -50.85 69.49 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.316 0.962 . . . . 0.0 112.409 175.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.98 -44.61 84.42 Favored 'General case' 0 C--O 1.245 0.816 0 C-N-CA 123.197 0.599 . . . . 0.0 112.037 -178.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 26.6 mt -59.13 -51.29 70.66 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 124.297 1.039 . . . . 0.0 111.788 173.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.13 -40.87 97.38 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.996 179.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.8 tttm -58.29 -51.11 71.17 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.098 1.317 . . . . 0.0 111.994 174.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.0 -48.77 78.83 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.27 0.628 . . . . 0.0 112.44 177.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -58.87 -50.04 75.51 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.306 1.042 . . . . 0.0 110.941 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.11 -41.72 84.19 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.332 1.453 . . . . 0.0 113.269 175.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -55.76 -52.58 63.45 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.55 1.14 . . . . 0.0 112.209 172.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.55 -31.84 72.19 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 54.1 t -73.26 -24.27 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 C-N-CA 125.512 1.525 . . . . 0.0 112.783 176.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.68 -34.62 65.2 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 176.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.9 pttt -84.4 0.18 50.43 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.297 1.439 . . . . 0.0 114.349 174.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.7 ttm -103.0 -159.64 0.74 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.947 2.099 . . . . 0.0 111.445 -173.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -58.72 154.78 34.19 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 125.339 1.456 . . . . 0.0 113.665 178.459 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -68.51 -45.73 2.34 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.573 2.849 . . . . 0.0 112.762 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -33.48 72.63 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.966 1.306 . . . . 0.0 112.893 176.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.97 -48.72 75.32 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 122.795 0.438 . . . . 0.0 110.218 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.2 -44.84 68.28 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.95 173.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -59.44 -55.44 34.58 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.522 1.055 . . . . 0.0 110.903 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.89 -51.49 69.38 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.242 0.617 . . . . 0.0 112.251 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.75 -39.25 93.83 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.5 -44.44 94.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.26 0.936 . . . . 0.0 111.104 174.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.55 -45.42 88.99 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.502 0.721 . . . . 0.0 112.782 172.07 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.422 ' HA ' HG22 ' A' ' 94' ' ' ILE . 7.8 mp -64.47 -34.77 78.97 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.888 0.767 . . . . 0.0 112.372 173.111 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 15.6 t -70.9 -45.12 64.88 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 120.686 -1.259 . . . . 0.0 112.903 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? -66.47 -49.24 67.28 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.225 0.61 . . . . 0.0 109.987 175.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.422 HG22 ' HA ' ' A' ' 91' ' ' LEU . 9.1 tt -65.32 -32.39 58.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 118.958 0.799 . . . . 0.0 112.509 -176.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.34 -19.4 63.31 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 N--CA 1.475 0.793 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 170.637 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.513 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -46.94 -32.49 3.88 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.217 1.407 . . . . 0.0 113.247 169.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -55.56 -60.09 3.91 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.119 0.967 . . . . 0.0 111.336 169.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.513 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -65.99 -34.05 77.22 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.212 -0.93 . . . . 0.0 112.332 -176.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.71 -54.58 42.56 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.866 0.866 . . . . 0.0 110.83 171.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -56.06 -52.49 64.08 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 118.375 -0.821 . . . . 0.0 112.062 174.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.9 mm -51.84 -49.19 37.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.208 1.403 . . . . 0.0 111.073 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -67.15 -43.77 81.48 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.683 1.129 . . . . 0.0 112.842 178.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.14 -49.19 78.82 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.83 0.852 . . . . 0.0 111.319 177.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.4 pp -68.76 -37.3 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 118.615 -0.707 . . . . 0.0 112.247 174.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.6 t80 . . . . . 0 N--CA 1.473 0.705 0 C-N-CA 124.744 1.218 . . . . 0.0 112.68 177.568 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo . . . . . 0 CA--C 1.535 0.554 0 CA-C-O 121.747 0.645 . . . . 0.0 112.548 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.06 -23.95 66.8 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.912 176.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 61.3 m -68.72 -39.22 80.51 Favored 'General case' 0 C--N 1.352 0.677 0 CA-C-O 117.346 -1.312 . . . . 0.0 114.217 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.3 p -79.6 -37.82 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-N 119.098 0.863 . . . . 0.0 110.189 175.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -57.55 -48.26 79.8 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.126 0.875 . . . . 0.0 111.669 173.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -68.34 -43.01 78.45 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.086 0.857 . . . . 0.0 112.541 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -64.95 -32.87 74.8 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.251 -0.905 . . . . 0.0 112.859 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.406 HD12 ' C ' ' A' ' 124' ' ' LEU . 0.6 OUTLIER -90.86 -19.94 22.83 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.355 1.062 . . . . 0.0 113.418 179.618 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.477 0.913 0 C-N-CA 125.084 1.354 . . . . 0.0 112.815 178.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 . . . . . 0 CA--C 1.551 1.01 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -112.19 93.01 4.24 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.153 1.381 . . . . 0.0 110.756 177.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.8 p -138.83 160.38 63.26 Favored Pre-proline 0 N--CA 1.469 0.515 0 C-N-CA 125.348 1.459 . . . . 0.0 111.976 -176.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -66.91 169.26 15.19 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 123.576 2.851 . . . . 0.0 112.914 175.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -65.8 116.56 4.03 Favored 'Trans proline' 0 CA--C 1.548 1.176 0 C-N-CA 123.091 2.527 . . . . 0.0 112.043 172.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -73.7 -19.08 21.65 Favored 'Trans proline' 0 CA--C 1.554 1.493 0 C-N-CA 122.438 2.092 . . . . 0.0 116.604 165.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.78 168.39 23.91 Favored 'Trans proline' 0 C--N 1.362 1.24 0 CA-C-N 124.462 2.629 . . . . 0.0 112.353 176.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -60.44 127.96 24.51 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.673 2.249 . . . . 0.0 111.181 170.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -51.88 -41.71 62.12 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.522 0.677 . . . . 0.0 111.747 168.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.704 ' H ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -95.86 41.87 1.1 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 128.62 2.768 . . . . 0.0 112.954 176.772 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.6 112.68 0.58 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.873 1.269 . . . . 0.0 113.039 174.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.15 -16.45 2.12 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 126.128 1.823 . . . . 0.0 114.236 -177.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.05 160.42 78.37 Favored Pre-proline 0 CA--C 1.558 1.274 0 C-N-CA 125.535 1.534 . . . . 0.0 113.866 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -75.71 171.34 18.38 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.899 3.066 . . . . 0.0 113.545 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -53.86 -36.62 62.82 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.463 1.105 . . . . 0.0 113.785 -176.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -53.4 -42.34 66.87 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.711 1.604 . . . . 0.0 112.551 173.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 77.8 t -77.47 -41.55 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 C-N-CA 124.649 1.18 . . . . 0.0 111.673 173.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 69.3 t -55.24 -37.81 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 118.641 0.655 . . . . 0.0 111.583 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.0 tptm -62.48 -50.67 70.49 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.245 -0.909 . . . . 0.0 111.865 172.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.49 -46.51 80.43 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.003 0.82 . . . . 0.0 112.515 176.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -53.84 49.17 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.775 0.83 . . . . 0.0 111.527 172.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -64.03 -44.93 91.05 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.521 1.055 . . . . 0.0 113.209 -178.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.42 -37.97 82.57 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.248 1.019 . . . . 0.0 111.589 177.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.445 HD23 HD22 ' A' ' 40' ' ' LEU . 12.6 tp -66.7 -46.02 76.92 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 122.966 0.506 . . . . 0.0 111.259 169.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.628 HD12 HD21 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -64.63 -42.53 95.41 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -178.666 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.36 -29.34 61.29 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.993 1.27 . . . . 0.0 113.361 177.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.7 tttp -72.67 -33.95 66.89 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.686 1.195 . . . . 0.0 112.989 175.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . 0.285 15.9 p30 -109.78 22.1 16.09 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.983 1.313 . . . . 0.0 113.934 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -58.72 -24.54 61.66 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 120.05 -1.656 . . . . 0.0 113.178 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 31.9 p -96.87 -0.89 47.04 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 127.522 2.329 . . . . 0.0 114.388 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -77.87 179.72 6.54 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.876 1.671 . . . . 0.0 112.969 173.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.86 171.5 9.56 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.378 2.271 . . . . 0.0 112.503 173.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -59.13 8.76 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 125.413 1.485 . . . . 0.0 112.556 175.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -66.43 -28.41 46.27 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 122.254 1.97 . . . . 0.0 113.65 -178.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -72.71 -39.89 66.6 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.439 -0.788 . . . . 0.0 111.669 -176.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 52.7 mt -70.52 -53.04 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.669 1.188 . . . . 0.0 110.21 171.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -57.97 -36.83 73.14 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 118.39 -0.814 . . . . 0.0 112.051 -176.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -52.79 -57.28 10.7 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.078 1.351 . . . . 0.0 111.77 172.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.38 -41.37 96.99 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.5 0.72 . . . . 0.0 111.691 -177.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.748 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.8 mm? -61.45 -47.45 85.67 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.001 0.92 . . . . 0.0 111.384 174.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -62.46 -38.6 90.43 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.323 1.049 . . . . 0.0 113.105 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.33 -49.93 68.58 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.405 -0.809 . . . . 0.0 112.578 179.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.748 ' HE1' HD13 ' A' ' 40' ' ' LEU . 7.6 p-90 -73.73 -33.93 64.54 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 172.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.549 HG23 HD12 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -58.44 -30.39 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 125.074 1.35 . . . . 0.0 112.82 174.538 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.83 -16.66 18.23 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 118.836 0.743 . . . . 0.0 112.875 176.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.44 -16.21 21.32 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.189 1.396 . . . . 0.0 113.902 173.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.628 HD11 ' CH2' ' A' ' 43' ' ' TRP . 40.2 mt -66.88 -65.11 0.72 Allowed 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.024 0.829 . . . . 0.0 112.629 175.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 77.59 90.8 0.3 Allowed Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.133 0.873 . . . . 0.0 112.592 -177.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -169.48 -167.24 29.75 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.204 1.383 . . . . 0.0 112.399 -178.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -56.66 -19.5 16.68 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.254 1.421 . . . . 0.0 113.426 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -55.88 -21.02 17.92 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.768 2.027 . . . . 0.0 113.545 173.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -36.56 63.25 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.126 1.77 . . . . 0.0 113.539 171.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.66 -40.64 72.89 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.122 0.969 . . . . 0.0 111.32 177.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -59.45 -43.75 93.12 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 117.941 -1.028 . . . . 0.0 111.575 168.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -56.96 -52.69 64.21 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 120.635 1.562 . . . . 0.0 112.911 172.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -58.5 -42.72 88.29 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.706 0.685 . . . . 0.0 111.673 -177.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.09 -37.17 69.63 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 178.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -64.41 -50.55 67.17 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 125.185 1.394 . . . . 0.0 112.173 177.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -53.76 -45.37 70.58 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 122.801 0.44 . . . . 0.0 110.876 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 49.4 mttm -59.94 -54.06 50.54 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.322 1.049 . . . . 0.0 113.125 172.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -55.32 -47.93 74.91 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.708 1.14 . . . . 0.0 112.604 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -61.5 -53.32 57.92 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 124.375 1.07 . . . . 0.0 112.156 177.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt -56.08 -35.6 67.16 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.574 0.749 . . . . 0.0 111.661 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.72 -50.57 34.85 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.838 0.855 . . . . 0.0 111.48 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.8 tttt -58.83 -49.71 76.7 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.554 0.742 . . . . 0.0 110.688 176.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -62.31 -49.16 76.74 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.636 0.774 . . . . 0.0 111.954 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.01 -44.55 94.5 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.006 0.821 . . . . 0.0 111.9 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -66.72 -46.27 76.03 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.601 0.761 . . . . 0.0 112.224 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.8 tt -54.93 -51.13 67.06 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.804 0.842 . . . . 0.0 111.166 169.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.52 -40.09 96.13 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 118.553 -0.736 . . . . 0.0 112.176 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -57.77 -50.92 71.63 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.724 1.21 . . . . 0.0 111.929 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.15 -48.56 73.13 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.314 0.646 . . . . 0.0 112.156 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -59.33 -48.91 79.83 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.161 0.984 . . . . 0.0 110.708 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -55.65 -46.36 77.48 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.763 1.225 . . . . 0.0 113.039 173.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -51.69 65.69 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.174 0.897 . . . . 0.0 111.772 176.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.43 -32.93 74.81 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 175.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 48.8 t -72.69 -25.42 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 125.312 1.445 . . . . 0.0 113.139 178.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.85 -29.63 67.1 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.1 ptmt -89.24 -3.19 58.64 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.863 1.665 . . . . 0.0 114.16 172.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.7 tpp -94.74 -163.54 1.06 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.339 1.856 . . . . 0.0 112.018 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -52.64 152.18 7.02 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 126.94 2.096 . . . . 0.0 114.118 172.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -72.52 -39.11 2.89 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.697 2.932 . . . . 0.0 113.876 -174.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -62.86 -33.04 74.44 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 121.102 -0.999 . . . . 0.0 112.437 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.26 -44.06 92.93 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.902 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.04 -42.63 65.92 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.098 1.359 . . . . 0.0 112.634 173.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.3 mmtm -65.5 -52.62 51.42 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.279 1.432 . . . . 0.0 111.681 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.87 -53.16 60.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.501 0.72 . . . . 0.0 112.16 173.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.31 -36.0 82.69 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 114.171 1.174 . . . . 0.0 114.171 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.11 -48.48 81.53 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.133 0.879 . . . . 0.0 111.216 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -56.64 -49.58 74.6 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 171.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.2 mt -60.7 -35.17 75.62 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.543 0.737 . . . . 0.0 112.296 178.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.4 t -73.05 -46.55 51.11 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.678 1.191 . . . . 0.0 113.043 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -65.97 -43.03 89.05 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.514 -0.741 . . . . 0.0 110.89 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.1 tt -68.95 -34.62 65.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.88 -18.06 63.81 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -99.74 -19.16 16.88 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.282 1.033 . . . . 0.0 113.732 169.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -147.44 80.99 1.52 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.61 1.564 . . . . 0.0 112.014 -175.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -65.51 -25.1 67.31 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 120.655 -1.278 . . . . 0.0 113.246 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.8 t -67.21 -20.16 65.65 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.975 1.31 . . . . 0.0 113.861 177.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 78.5 mt -81.19 84.13 6.64 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.574 1.15 . . . . 0.0 110.379 173.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 14.1 m-20 -89.42 176.71 6.81 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.4 1.48 . . . . 0.0 112.146 170.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 93.89 -26.17 18.0 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.832 1.682 . . . . 0.0 114.029 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.491 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -63.85 -23.18 32.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-N 118.374 1.087 . . . . 0.0 112.54 176.488 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -48.72 -38.06 20.49 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.218 -0.926 . . . . 0.0 112.554 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -58.93 -59.33 5.63 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.289 0.636 . . . . 0.0 111.225 173.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.491 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.64 -35.37 80.79 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.934 0.788 . . . . 0.0 112.623 -176.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 9.0 tm0? -59.09 -46.25 88.77 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.926 0.89 . . . . 0.0 111.554 171.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -50.35 74.03 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.396 -0.812 . . . . 0.0 111.494 173.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 31.0 mm -51.11 -50.84 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 124.793 1.237 . . . . 0.0 110.797 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -64.03 -45.99 86.45 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.604 0.638 . . . . 0.0 112.053 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.15 -44.78 83.75 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.501 0.72 . . . . 0.0 111.8 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 28.0 pt -71.54 -41.11 72.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-O 118.746 -0.645 . . . . 0.0 112.556 173.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -57.15 -39.79 75.92 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.362 1.437 . . . . 0.0 112.857 -178.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -66.59 -16.03 63.87 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.125 1.37 . . . . 0.0 113.038 176.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.0 t -122.31 21.09 10.43 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.701 2.0 . . . . 0.0 113.102 176.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 30.1 mt -109.36 75.89 0.78 Allowed Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 126.544 1.938 . . . . 0.0 110.531 170.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.14 168.65 18.57 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.934 2.423 . . . . 0.0 111.975 171.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -63.2 -23.39 67.41 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.317 -0.865 . . . . 0.0 112.791 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.3 m -62.44 -51.7 66.48 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.318 0.963 . . . . 0.0 112.118 176.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.476 HG22 HD23 ' A' ' 124' ' ' LEU . 10.8 p -72.23 -39.96 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 118.249 0.477 . . . . 0.0 111.414 178.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.82 -46.42 84.73 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.779 173.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -69.18 -40.27 78.19 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.605 1.093 . . . . 0.0 113.438 177.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -68.65 -31.28 70.31 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 121.039 -1.038 . . . . 0.0 113.055 177.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.476 HD23 HG22 ' A' ' 120' ' ' VAL . 0.6 OUTLIER -93.34 -16.95 24.11 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.447 1.099 . . . . 0.0 113.594 178.486 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -53.38 -38.52 63.44 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.939 1.296 . . . . 0.0 112.367 174.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.7 tttt -80.64 -31.06 36.58 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 173.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 168.98 -97.16 0.12 Allowed Glycine 0 CA--C 1.532 1.154 0 N-CA-C 114.925 0.73 . . . . 0.0 114.925 172.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.35 61.05 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 125.643 1.577 . . . . 0.0 111.185 -171.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 51.65 74.75 0.26 Allowed Glycine 0 CA--C 1.54 1.604 0 C-N-CA 126.058 1.789 . . . . 0.0 113.076 -174.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.87 108.42 2.1 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.932 3.088 . . . . 0.0 111.984 -174.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 48.3 63.98 1.85 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 126.779 2.032 . . . . 0.0 113.771 -176.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 42.3 t -116.98 133.09 23.14 Favored Pre-proline 0 N--CA 1.48 1.033 0 C-N-CA 125.939 1.696 . . . . 0.0 110.495 -176.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -70.47 177.06 6.46 Favored 'Trans proline' 0 CA--C 1.546 1.109 0 C-N-CA 123.872 3.048 . . . . 0.0 113.302 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.252 1.236 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 175.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 . . . . . 0 CA--C 1.545 0.77 0 CA-C-O 121.003 0.43 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -153.03 -65.69 0.16 Allowed 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.232 -0.918 . . . . 0.0 112.327 174.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.7 p -115.58 162.79 23.22 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 126.86 2.064 . . . . 0.0 112.482 -179.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.63 167.71 22.0 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.089 2.526 . . . . 0.0 113.506 176.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -64.4 127.13 18.34 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.79 2.993 . . . . 0.0 111.648 175.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -67.81 -25.29 39.54 Favored 'Trans proline' 0 CA--C 1.551 1.368 0 C-N-CA 122.442 2.095 . . . . 0.0 116.367 167.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.4 163.87 34.85 Favored 'Trans proline' 0 C--N 1.362 1.254 0 CA-C-N 124.116 2.506 . . . . 0.0 112.754 176.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 36.8 Cg_endo -61.4 133.81 48.17 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.9 2.4 . . . . 0.0 111.34 171.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -49.9 -43.67 49.67 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.335 0.654 . . . . 0.0 111.669 169.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.551 HD23 ' H ' ' A' ' 10' ' ' LEU . 1.8 pt? -83.06 18.91 1.53 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.216 1.807 . . . . 0.0 115.102 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.36 105.59 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.625 1.97 . . . . 0.0 115.24 -173.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.28 26.68 0.2 Allowed Glycine 0 CA--C 1.537 1.465 0 C-N-CA 124.757 1.17 . . . . 0.0 114.661 -172.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -120.97 156.85 56.33 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 126.198 1.799 . . . . 0.0 112.01 -174.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.404 ' O ' HG23 ' A' ' 18' ' ' VAL . 81.8 Cg_endo -73.45 166.39 29.98 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 123.394 2.73 . . . . 0.0 113.239 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -52.46 -41.02 62.96 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.512 1.525 . . . . 0.0 113.133 -179.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -55.36 -39.54 70.18 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.883 1.673 . . . . 0.0 113.027 175.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 74.8 t -80.35 -40.33 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 124.881 1.273 . . . . 0.0 111.705 175.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 14' ' ' PRO . 54.1 t -55.9 -39.81 58.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.876 0.87 . . . . 0.0 110.987 177.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -59.72 -50.66 72.96 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 121.002 -1.061 . . . . 0.0 112.178 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.57 -47.02 83.23 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.852 0.861 . . . . 0.0 111.818 178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.406 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.9 OUTLIER -51.96 -50.09 61.93 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.498 1.119 . . . . 0.0 111.861 168.182 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -44.82 95.52 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.225 0.92 . . . . 0.0 113.038 -178.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -65.85 -34.86 79.13 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.546 -0.721 . . . . 0.0 111.789 176.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 tp -66.64 -41.05 88.87 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 171.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -72.23 -25.56 61.68 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.5 mmtt -53.62 -46.76 70.55 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.583 1.083 . . . . 0.0 113.051 175.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.0 ptmt -70.06 -24.77 63.3 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 173.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -104.21 17.56 23.88 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 126.761 2.025 . . . . 0.0 113.008 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.68 -19.07 65.52 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 120.185 -1.572 . . . . 0.0 113.175 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.2 p -98.6 3.41 47.96 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 127.871 2.469 . . . . 0.0 114.206 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -73.37 179.61 3.89 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.426 1.49 . . . . 0.0 112.802 173.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -117.65 172.49 7.32 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 127.513 2.325 . . . . 0.0 111.227 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.7 -57.62 6.53 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 126.544 1.938 . . . . 0.0 112.826 176.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -69.73 -37.33 9.38 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.349 2.033 . . . . 0.0 113.426 177.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -64.79 -41.57 95.72 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 120.788 -1.195 . . . . 0.0 112.269 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 56.8 mt -67.14 -53.29 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-O 118.431 -0.795 . . . . 0.0 109.428 174.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -57.39 -41.04 79.5 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.555 1.071 . . . . 0.0 112.187 -175.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 6.5 mmpt? -57.14 -60.79 3.08 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.3 1.44 . . . . 0.0 112.806 174.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.14 -33.96 77.27 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -174.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.711 HD13 ' HE1' ' A' ' 43' ' ' TRP . 0.9 OUTLIER -66.93 -50.14 63.31 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 124.649 1.179 . . . . 0.0 111.235 173.488 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -55.28 -39.42 69.84 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.983 0.81 . . . . 0.0 112.912 175.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.36 -50.23 67.97 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.711 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.4 p-90 -73.8 -34.5 64.64 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 169.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -56.56 -32.19 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 125.194 1.397 . . . . 0.0 112.193 174.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.28 -19.27 44.74 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 118.935 0.789 . . . . 0.0 112.686 177.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 48.9 m -89.95 -24.49 21.28 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.983 1.313 . . . . 0.0 112.898 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.707 HD11 ' CH2' ' A' ' 43' ' ' TRP . 37.5 mt -64.12 -60.44 3.22 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 66.38 66.66 2.3 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.436 1.017 . . . . 0.0 114.044 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -147.71 53.04 0.54 Allowed Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.323 1.439 . . . . 0.0 113.758 -177.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.2 -3.12 2.15 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 128.705 2.802 . . . . 0.0 114.48 -176.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -62.32 -22.83 66.37 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.04 1.736 . . . . 0.0 114.252 -178.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.0 ptmt -53.58 -35.57 60.96 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.111 1.764 . . . . 0.0 113.427 172.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.78 -42.45 77.38 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.112 0.965 . . . . 0.0 112.147 176.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -56.85 -46.33 81.82 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.154 -0.966 . . . . 0.0 111.244 169.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -57.76 -46.12 84.97 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 174.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -58.31 -43.09 88.0 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.12 0.873 . . . . 0.0 110.975 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.99 -36.04 64.49 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -67.07 -52.64 39.63 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.077 -1.014 . . . . 0.0 112.604 174.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.2 ttpp -50.3 -52.33 37.49 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.733 0.813 . . . . 0.0 111.742 178.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 34.7 pttt -62.14 -42.06 98.88 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 118.185 -0.912 . . . . 0.0 113.418 175.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -57.38 -48.94 77.74 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.932 1.242 . . . . 0.0 111.73 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 13.3 mmt -64.27 -50.02 69.57 Favored 'General case' 0 N--CA 1.462 0.169 0 C-N-CA 123.032 0.533 . . . . 0.0 112.174 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -57.38 -35.02 69.46 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.292 0.637 . . . . 0.0 112.197 175.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.83 -51.5 22.14 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.236 1.014 . . . . 0.0 111.805 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -50.98 70.79 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.758 0.823 . . . . 0.0 110.599 174.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -60.88 -50.43 73.47 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.213 0.605 . . . . 0.0 111.99 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.13 92.95 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.803 0.728 . . . . 0.0 112.65 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -64.02 -50.33 68.9 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.772 0.829 . . . . 0.0 112.088 176.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 42.2 mt -55.66 -51.07 68.48 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.417 1.087 . . . . 0.0 110.724 175.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.428 ' HB1' ' HA ' ' A' ' 92' ' ' SER . . . -54.37 -51.35 65.09 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.118 0.967 . . . . 0.0 113.108 172.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -53.16 -50.74 63.97 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 120.218 1.372 . . . . 0.0 112.268 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.29 -48.85 74.1 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.424 0.689 . . . . 0.0 112.35 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.487 ' O ' HG23 ' A' ' 77' ' ' VAL . 8.9 m-70 -55.57 -52.88 62.27 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 123.804 0.842 . . . . 0.0 110.88 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -52.08 -46.96 65.4 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.997 2.119 . . . . 0.0 112.295 177.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -48.55 78.1 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.848 0.859 . . . . 0.0 112.26 174.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.63 -33.88 76.63 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 173.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 73' ' ' HIS . 92.6 t -69.98 -28.14 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 125.293 1.437 . . . . 0.0 111.925 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.04 -20.2 37.28 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 176.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.91 1.31 26.6 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 126.299 1.84 . . . . 0.0 114.173 173.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 tpp -98.64 -161.59 0.89 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.701 2.001 . . . . 0.0 112.025 -175.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.1 156.5 20.1 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 125.507 1.523 . . . . 0.0 113.942 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.56 -42.55 2.5 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.728 2.952 . . . . 0.0 113.345 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.64 -36.55 83.18 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.899 1.28 . . . . 0.0 112.571 177.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.62 -40.99 89.38 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.756 175.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -56.12 -45.72 79.42 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 117.852 -1.07 . . . . 0.0 112.368 176.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.31 -53.73 50.87 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.375 1.47 . . . . 0.0 111.369 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.63 -55.05 36.66 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.653 0.781 . . . . 0.0 111.885 176.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.25 -32.35 71.5 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -176.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.92 -46.38 89.61 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.023 -1.048 . . . . 0.0 111.856 170.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -58.53 -50.42 73.82 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.445 0.698 . . . . 0.0 111.977 171.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.2 mp -57.83 -34.58 69.83 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.646 0.657 . . . . 0.0 111.833 174.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.428 ' HA ' ' HB1' ' A' ' 70' ' ' ALA . 14.5 t -69.82 -50.83 39.01 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.012 -1.055 . . . . 0.0 112.657 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? -64.71 -40.2 94.94 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 118.677 -0.678 . . . . 0.0 110.898 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.5 tp -70.37 -37.15 69.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 119.224 0.92 . . . . 0.0 111.824 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.93 -21.0 65.13 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -176.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.91 -5.34 14.36 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.903 1.281 . . . . 0.0 113.634 174.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -156.63 78.4 0.93 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.33 1.452 . . . . 0.0 113.374 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -66.4 -12.84 59.2 Favored 'General case' 0 CA--C 1.55 0.953 0 O-C-N 120.19 -1.569 . . . . 0.0 113.504 177.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 t -74.93 -6.07 47.22 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.003 1.721 . . . . 0.0 114.502 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.7 mt -113.63 84.18 1.98 Allowed 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.354 1.462 . . . . 0.0 110.72 -177.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -94.23 153.22 18.17 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.682 0.793 . . . . 0.0 111.555 172.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 141.78 -69.33 0.44 Allowed Glycine 0 CA--C 1.529 0.965 0 C-N-CA 124.688 1.137 . . . . 0.0 112.805 -177.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -59.66 -27.88 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 CA-C-N 118.214 1.007 . . . . 0.0 112.591 -178.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -41.3 -46.43 3.23 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.906 1.682 . . . . 0.0 113.025 170.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -59.67 -59.13 5.92 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.615 0.766 . . . . 0.0 111.617 176.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -66.23 -35.62 80.9 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.671 0.789 . . . . 0.0 112.833 -175.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -53.86 -50.9 65.25 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 124.784 1.233 . . . . 0.0 110.779 167.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.4 tttt -57.29 -49.2 76.84 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.424 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 9.9 mm -54.74 -48.67 72.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.898 0.879 . . . . 0.0 111.758 176.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -64.5 -45.12 88.65 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.296 0.953 . . . . 0.0 112.844 177.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.51 -48.92 79.79 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.433 1.093 . . . . 0.0 111.822 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -68.88 -38.41 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.061 0.544 . . . . 0.0 112.142 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -62.56 -30.97 71.7 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.61 1.095 . . . . 0.0 113.016 177.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 10.2 mmtt -77.68 -11.1 59.84 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.111 1.364 . . . . 0.0 113.948 176.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.7 t -130.82 22.82 4.98 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.482 1.513 . . . . 0.0 112.763 179.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.56 HD23 ' HG3' ' A' ' 121' ' ' LYS . 0.0 OUTLIER -48.02 142.87 7.07 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 126.121 1.769 . . . . 0.0 112.9 -177.047 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -70.85 110.74 2.85 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.27 1.98 . . . . 0.0 110.45 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -55.05 -30.46 59.63 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.596 -0.69 . . . . 0.0 111.818 176.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 46.7 p -56.69 -50.73 71.26 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.066 1.746 . . . . 0.0 113.202 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.94 -41.79 94.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 CA-C-N 119.619 1.099 . . . . 0.0 110.507 177.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.56 ' HG3' HD23 ' A' ' 116' ' ' LEU . 27.5 mttt -62.55 -46.27 89.15 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.356 177.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.52 -37.86 87.97 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.978 1.263 . . . . 0.0 113.244 176.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -70.74 -37.43 73.46 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.271 -0.893 . . . . 0.0 112.531 177.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -87.02 -19.11 29.14 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.445 1.098 . . . . 0.0 113.272 179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.08 -37.44 61.67 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.789 1.636 . . . . 0.0 112.131 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -68.81 -43.88 74.66 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.186 1.394 . . . . 0.0 112.134 175.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 46.19 -136.03 8.98 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 125.243 1.401 . . . . 0.0 112.037 -175.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.1 pp -148.74 54.1 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 126.075 1.75 . . . . 0.0 111.542 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 49.84 75.1 0.22 Allowed Glycine 0 CA--C 1.54 1.606 0 C-N-CA 125.876 1.703 . . . . 0.0 113.115 -174.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -69.93 156.58 62.54 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.131 2.554 . . . . 0.0 111.993 -175.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 59.8 108.14 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 127.021 2.128 . . . . 0.0 113.13 -171.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 7.5 t -116.23 72.83 4.98 Favored Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 124.354 1.062 . . . . 0.0 110.366 177.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -74.23 -11.2 22.94 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.707 2.938 . . . . 0.0 114.144 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.18 0 C-N-CA 129.533 3.133 . . . . 0.0 114.49 -177.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.9 t70 . . . . . 0 N--CA 1.476 0.85 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.2 89.47 0.65 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.335 1.454 . . . . 0.0 111.984 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 p -96.47 160.48 29.48 Favored Pre-proline 0 C--O 1.238 0.465 0 C-N-CA 125.218 1.407 . . . . 0.0 112.458 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.71 162.84 37.64 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.779 2.986 . . . . 0.0 111.664 176.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -64.65 126.69 17.24 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.826 2.35 . . . . 0.0 110.772 175.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -68.19 -22.54 40.49 Favored 'Trans proline' 0 CA--C 1.552 1.383 0 C-N-CA 122.341 2.027 . . . . 0.0 116.281 167.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -69.89 167.95 23.13 Favored 'Trans proline' 0 C--N 1.362 1.274 0 CA-C-N 124.531 2.654 . . . . 0.0 113.828 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -61.21 119.74 7.05 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 123.629 2.886 . . . . 0.0 111.772 173.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -54.0 -27.87 34.47 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 172.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.478 ' H ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -108.08 35.34 3.18 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 128.122 2.569 . . . . 0.0 112.693 178.426 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -41.93 112.46 0.33 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.475 1.51 . . . . 0.0 114.044 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 151.42 -17.66 0.89 Allowed Glycine 0 CA--C 1.539 1.553 0 C-N-CA 126.588 2.042 . . . . 0.0 113.929 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.14 159.25 65.65 Favored Pre-proline 0 CA--C 1.553 1.089 0 C-N-CA 125.598 1.559 . . . . 0.0 113.919 -175.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.66 172.19 16.71 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.643 2.895 . . . . 0.0 113.27 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -53.65 -34.07 57.37 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.549 1.139 . . . . 0.0 113.438 -179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.62 -36.08 71.31 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.503 1.521 . . . . 0.0 112.65 175.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.46 HG13 ' HH2' ' A' ' 43' ' ' TRP . 43.3 t -79.14 -43.02 24.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 125.113 1.365 . . . . 0.0 111.553 170.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 86.0 t -53.36 -37.9 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 119.035 0.834 . . . . 0.0 111.642 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.9 tppt? -61.14 -51.1 70.49 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.001 -1.062 . . . . 0.0 112.402 174.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.12 -49.48 76.83 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.668 0.787 . . . . 0.0 111.283 176.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.06 -52.34 44.29 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.33 1.052 . . . . 0.0 111.827 171.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -61.41 -45.47 94.2 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.89 1.223 . . . . 0.0 113.226 -178.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -69.83 -26.42 64.22 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 122.949 0.5 . . . . 0.0 112.282 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -72.84 -54.15 9.56 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.005 0.922 . . . . 0.0 111.903 168.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.22 -43.12 82.54 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.704 1.602 . . . . 0.0 114.131 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.91 -27.11 64.94 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.508 1.049 . . . . 0.0 112.942 175.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.93 -38.08 66.94 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.966 1.706 . . . . 0.0 112.501 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -108.98 19.47 19.53 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.08 2.152 . . . . 0.0 113.99 177.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -59.23 -23.54 62.4 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 119.595 -1.941 . . . . 0.0 113.418 -176.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.2 p -82.14 2.13 32.94 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 128.929 2.892 . . . . 0.0 115.072 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -93.08 -176.06 4.05 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 126.548 1.939 . . . . 0.0 112.417 173.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.45 167.15 11.17 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.31 2.244 . . . . 0.0 111.745 174.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -43.5 -59.8 3.06 Favored Pre-proline 0 N--CA 1.473 0.705 0 C-N-CA 125.704 1.602 . . . . 0.0 113.313 174.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -66.75 -35.82 26.54 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 121.827 1.684 . . . . 0.0 113.642 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.42 -50.77 71.48 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.686 1.194 . . . . 0.0 111.324 -177.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 10.4 mt -66.94 -48.43 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.3 1.04 . . . . 0.0 112.379 172.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -49.49 -46.07 47.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.643 0.777 . . . . 0.0 110.574 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -52.04 -47.78 64.88 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.508 1.049 . . . . 0.0 113.328 174.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -63.13 -49.16 75.47 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.286 1.034 . . . . 0.0 111.79 178.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.703 HD13 ' HE1' ' A' ' 43' ' ' TRP . 4.0 mm? -58.75 -48.93 79.52 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.975 0.91 . . . . 0.0 110.433 176.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.439 ' HA ' ' HB ' ' A' ' 44' ' ' VAL . 31.7 m-20 -58.54 -35.29 72.09 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 125.008 1.323 . . . . 0.0 114.297 176.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.15 -53.49 57.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.553 0.615 . . . . 0.0 112.437 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.703 ' HE1' HD13 ' A' ' 40' ' ' LEU . 12.0 p-90 -73.29 -29.75 62.93 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 113.18 0.808 . . . . 0.0 113.18 175.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.703 HG22 HD12 ' A' ' 47' ' ' LEU . 1.6 t -60.22 -33.51 53.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.301 1.84 . . . . 0.0 113.588 172.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -56.71 -15.24 4.19 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 119.115 0.87 . . . . 0.0 112.818 173.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.18 -6.7 16.28 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.587 1.555 . . . . 0.0 114.147 176.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.703 HD12 HG22 ' A' ' 44' ' ' VAL . 13.6 mt -63.29 -60.02 3.94 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.671 1.123 . . . . 0.0 113.415 177.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -167.1 -150.59 6.5 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 125.686 1.612 . . . . 0.0 110.589 -168.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -123.8 4.89 9.17 Favored Glycine 0 N--CA 1.47 0.961 0 N-CA-C 116.988 1.555 . . . . 0.0 116.988 -174.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -102.82 -37.5 7.83 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.808 1.643 . . . . 0.0 111.983 173.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -74.63 -24.26 58.82 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.045 0.938 . . . . 0.0 112.171 -177.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.97 -33.1 62.1 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.543 1.537 . . . . 0.0 113.732 170.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.19 -33.19 75.22 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.13 0.572 . . . . 0.0 111.336 176.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -63.61 -39.55 94.66 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.692 172.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -64.62 -54.15 36.41 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 119.657 1.117 . . . . 0.0 113.192 174.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.48 -40.73 87.91 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.933 -0.48 . . . . 0.0 111.809 -178.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.6 -38.25 67.86 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.99 0.916 . . . . 0.0 112.452 178.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.401 ' CE1' ' HB2' ' A' ' 62' ' ' MET . 4.3 t80 -55.8 -50.65 69.9 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 124.412 1.085 . . . . 0.0 111.475 173.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.7 ttmm -50.22 -49.83 51.55 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.535 0.607 . . . . 0.0 111.107 -177.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -59.7 -54.35 47.4 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.479 1.512 . . . . 0.0 113.744 172.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -52.63 -47.31 67.12 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.08 0.952 . . . . 0.0 112.066 178.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.401 ' HB2' ' CE1' ' A' ' 58' ' ' PHE . 0.9 OUTLIER -61.97 -52.8 62.55 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.878 1.271 . . . . 0.0 112.335 177.319 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -54.74 -34.65 62.78 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.819 -0.61 . . . . 0.0 112.505 174.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.71 -51.96 24.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.97 0.805 . . . . 0.0 111.933 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -58.84 -47.45 84.81 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.37 0.668 . . . . 0.0 111.482 177.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -60.73 -50.95 71.4 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.739 1.216 . . . . 0.0 112.08 176.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.79 -49.61 74.83 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.773 1.169 . . . . 0.0 112.915 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -62.37 -50.67 70.65 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.878 0.871 . . . . 0.0 112.201 178.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tp -56.04 -50.3 71.33 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.662 0.785 . . . . 0.0 111.156 175.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.88 -45.75 85.9 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.347 1.059 . . . . 0.0 111.915 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.5 tptt -57.48 -48.42 79.25 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.564 1.075 . . . . 0.0 112.425 176.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.05 -48.84 78.44 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.455 0.702 . . . . 0.0 112.254 176.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.418 ' O ' HG23 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -58.39 -50.0 75.25 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.737 1.215 . . . . 0.0 110.878 178.544 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -51.96 -49.47 63.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 126.382 1.873 . . . . 0.0 112.401 172.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -56.18 -49.08 75.02 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.687 0.795 . . . . 0.0 111.97 178.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.9 -33.41 75.53 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 174.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 73' ' ' HIS . 56.0 t -69.51 -27.54 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 C-N-CA 124.814 1.246 . . . . 0.0 112.679 178.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.16 -28.73 42.19 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 175.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -98.63 -1.76 40.07 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.973 1.709 . . . . 0.0 114.463 175.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -90.24 -84.68 0.23 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.421 1.088 . . . . 0.0 111.251 175.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -129.97 154.21 81.14 Favored Pre-proline 0 N--CA 1.479 1.02 0 C-N-CA 126.508 1.923 . . . . 0.0 112.991 -173.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -69.93 -48.31 0.71 Allowed 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 123.683 2.922 . . . . 0.0 112.611 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -72.66 -33.72 66.75 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.88 -41.55 82.77 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 119.024 -0.513 . . . . 0.0 110.323 174.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.66 -48.98 74.13 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 117.87 -1.062 . . . . 0.0 110.302 173.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -56.38 -54.03 50.36 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.22 0.918 . . . . 0.0 110.736 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.08 -50.82 72.62 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.364 -0.835 . . . . 0.0 113.247 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -67.46 -44.16 79.3 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.815 0.846 . . . . 0.0 112.589 -177.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.86 93.77 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 124.441 1.097 . . . . 0.0 111.912 173.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.401 ' OE1' ' HE3' ' A' ' 93' ' ' LYS . 0.5 OUTLIER -59.99 -44.02 94.79 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.163 0.585 . . . . 0.0 111.73 174.367 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.442 ' HA ' HG22 ' A' ' 94' ' ' ILE . 1.8 mm? -63.47 -35.05 79.17 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 172.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.3 t -69.6 -47.24 64.17 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.43 1.092 . . . . 0.0 112.485 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.401 ' HE3' ' OE1' ' A' ' 90' ' ' GLU . 1.6 ptpm? -67.95 -41.58 82.25 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.615 0.766 . . . . 0.0 111.157 177.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.442 HG22 ' HA ' ' A' ' 91' ' ' LEU . 7.2 tt -71.07 -32.91 49.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 118.986 0.812 . . . . 0.0 112.6 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.64 -30.36 68.67 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.08 -4.43 16.61 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.755 1.222 . . . . 0.0 113.69 177.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -157.83 79.88 0.86 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.297 1.439 . . . . 0.0 112.718 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -64.92 -12.48 49.77 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 120.236 -1.54 . . . . 0.0 114.12 176.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.8 t -82.14 -14.05 56.28 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.261 1.425 . . . . 0.0 113.833 176.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 77.4 mt -76.69 84.1 3.32 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.03 -1.044 . . . . 0.0 110.921 169.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -92.62 169.25 10.66 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.265 1.026 . . . . 0.0 111.854 168.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 120.94 -74.3 0.34 Allowed Glycine 0 N--CA 1.47 0.91 0 C-N-CA 126.046 1.784 . . . . 0.0 111.801 177.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.41 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.2 OUTLIER -59.39 -27.72 37.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 123.717 0.807 . . . . 0.0 112.578 -177.427 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -31.5 4.42 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.344 1.458 . . . . 0.0 114.078 173.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -62.15 -59.81 4.52 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.115 171.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.41 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -62.33 -35.13 78.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.394 0.997 . . . . 0.0 112.269 -177.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -59.11 -49.45 77.84 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.616 0.766 . . . . 0.0 112.416 172.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.59 -51.84 67.12 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 117.786 -1.102 . . . . 0.0 110.993 172.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 31.3 mm -49.72 -49.91 19.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.619 1.168 . . . . 0.0 111.355 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -62.09 -52.18 64.93 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.693 0.679 . . . . 0.0 111.856 176.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.1 -33.77 71.23 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.9 pt -79.33 -39.76 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 118.161 -0.923 . . . . 0.0 112.069 169.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 93.7 t80 -54.85 -38.95 68.1 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 121.308 1.867 . . . . 0.0 113.837 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.23 -16.98 64.61 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 174.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 1.7 t -132.67 35.66 3.58 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.246 2.218 . . . . 0.0 112.56 -177.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 9.3 mt -109.15 72.31 0.5 Allowed Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 126.919 2.088 . . . . 0.0 110.109 174.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.23 170.95 11.05 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 123.256 2.637 . . . . 0.0 112.734 173.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -59.16 -26.87 65.13 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 173.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 23.5 p -65.59 -50.08 66.41 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 120.027 1.285 . . . . 0.0 112.833 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.4 p -69.06 -39.3 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.42 0.688 . . . . 0.0 111.551 175.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 10.0 mtpt -59.13 -47.05 86.69 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 118.254 -0.879 . . . . 0.0 112.372 171.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -65.98 -41.28 91.35 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 119.971 1.26 . . . . 0.0 112.786 177.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.08 -37.06 80.8 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.986 -1.072 . . . . 0.0 112.835 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.44 -19.13 31.77 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.474 1.109 . . . . 0.0 113.309 178.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -55.56 -21.9 19.35 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.492 1.917 . . . . 0.0 113.922 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -57.3 -29.15 63.67 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.621 1.568 . . . . 0.0 113.326 170.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 122.08 -175.69 16.36 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 126.192 1.853 . . . . 0.0 113.672 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -132.77 63.76 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 126.315 1.846 . . . . 0.0 111.274 -171.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 51.4 75.3 0.22 Allowed Glycine 0 CA--C 1.542 1.772 0 C-N-CA 125.784 1.659 . . . . 0.0 113.348 -175.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -70.31 172.15 13.71 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.733 2.956 . . . . 0.0 112.958 -176.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -134.79 93.59 3.05 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.176 1.391 . . . . 0.0 111.637 -177.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 14.9 p -83.0 133.68 47.87 Favored Pre-proline 0 N--CA 1.477 0.895 0 C-N-CA 124.733 1.213 . . . . 0.0 111.264 175.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -70.92 -178.39 2.76 Favored 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 123.741 2.961 . . . . 0.0 112.641 173.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.252 1.215 0 C-N-CA 125.374 1.47 . . . . 0.0 112.413 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 2.2 t70 . . . . . 0 CA--C 1.548 0.871 0 CA-C-O 120.952 0.406 . . . . 0.0 111.804 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.95 145.7 53.4 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 121.259 -0.901 . . . . 0.0 111.924 174.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -79.0 159.13 73.96 Favored Pre-proline 0 N--CA 1.474 0.747 0 C-N-CA 124.586 1.154 . . . . 0.0 113.343 177.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -69.94 167.53 24.41 Favored 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 123.77 2.98 . . . . 0.0 112.064 176.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.73 129.07 22.49 Favored 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 123.529 2.819 . . . . 0.0 111.578 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -67.21 -26.01 42.56 Favored 'Trans proline' 0 CA--C 1.55 1.321 0 C-N-CA 122.367 2.045 . . . . 0.0 115.928 167.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.66 162.9 39.13 Favored 'Trans proline' 0 C--N 1.362 1.245 0 CA-C-N 123.954 2.448 . . . . 0.0 112.834 177.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -62.12 140.72 85.46 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.066 2.51 . . . . 0.0 111.827 171.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -52.32 -42.09 63.55 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.634 0.73 . . . . 0.0 112.221 171.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.542 HD23 ' H ' ' A' ' 10' ' ' LEU . 1.7 pt? -84.76 19.22 2.11 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.604 1.962 . . . . 0.0 114.873 179.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -34.49 101.5 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.411 2.285 . . . . 0.0 115.548 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.64 29.1 0.14 Allowed Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.058 0.837 . . . . 0.0 114.498 -171.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.04 156.93 59.17 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 125.264 1.426 . . . . 0.0 111.692 -176.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -73.01 169.5 22.05 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.3 2.666 . . . . 0.0 112.777 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -54.12 -38.89 65.92 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.455 1.102 . . . . 0.0 113.423 -177.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.88 -39.24 68.5 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.523 1.529 . . . . 0.0 112.65 174.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.4 t -81.49 -39.63 17.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 C-N-CA 124.899 1.28 . . . . 0.0 111.662 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 49.1 t -55.22 -40.95 58.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.881 0.872 . . . . 0.0 110.847 176.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.8 tppt? -60.45 -50.66 72.68 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.929 -1.107 . . . . 0.0 112.378 175.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.24 -48.0 77.36 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.822 0.849 . . . . 0.0 111.855 177.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.54 -50.73 59.46 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.094 0.958 . . . . 0.0 112.025 169.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.51 -47.38 86.4 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.968 0.804 . . . . 0.0 112.362 -177.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -66.48 -32.37 73.69 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.321 0.648 . . . . 0.0 112.096 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.6 tp -66.53 -49.08 67.67 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.563 0.745 . . . . 0.0 112.109 169.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.25 -25.13 68.18 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.526 1.53 . . . . 0.0 114.496 177.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -53.17 -33.11 51.16 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 119.888 1.222 . . . . 0.0 113.734 173.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.47 -38.81 65.31 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.296 1.038 . . . . 0.0 112.955 169.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -97.49 19.44 13.36 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.02 1.328 . . . . 0.0 113.096 -175.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.06 -19.83 63.33 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.323 -1.486 . . . . 0.0 114.395 -176.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.28 8.02 21.3 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 126.322 1.849 . . . . 0.0 113.002 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.5 mptt -75.8 178.97 5.76 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 120.638 -1.289 . . . . 0.0 111.658 176.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.09 171.27 7.47 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.441 1.897 . . . . 0.0 111.011 176.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -45.97 -59.08 5.19 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.825 1.65 . . . . 0.0 112.785 174.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -66.42 -38.57 19.46 Favored 'Trans proline' 0 C--N 1.357 1.016 0 C-N-CA 122.312 2.008 . . . . 0.0 112.613 178.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.26 -41.87 97.66 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.121 -0.987 . . . . 0.0 112.117 -177.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 12.1 mt -69.43 -51.45 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 124.103 0.961 . . . . 0.0 110.213 171.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -51.0 -38.08 49.03 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.05 0.841 . . . . 0.0 112.502 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.01 -60.3 3.64 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.383 1.473 . . . . 0.0 111.643 -179.081 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -64.08 -37.4 87.3 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.216 0.606 . . . . 0.0 112.19 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.719 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.1 mm? -64.68 -50.61 66.36 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.641 0.776 . . . . 0.0 110.93 174.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -56.85 -37.97 72.04 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 118.949 0.795 . . . . 0.0 113.014 176.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.07 -50.8 65.95 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -178.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.719 ' HE1' HD13 ' A' ' 40' ' ' LEU . 9.4 p-90 -73.53 -36.38 65.69 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 170.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.419 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.7 OUTLIER -56.89 -32.88 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.086 1.354 . . . . 0.0 112.118 175.977 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -59.73 -16.39 26.99 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.663 0.785 . . . . 0.0 112.538 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.8 m -102.01 -15.9 16.64 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.172 1.389 . . . . 0.0 112.607 177.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.638 HD11 ' CH2' ' A' ' 43' ' ' TRP . 15.2 mt -60.59 -56.22 23.92 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 177.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -179.11 -159.07 22.66 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 123.715 0.674 . . . . 0.0 112.572 -168.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -123.9 20.9 7.13 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 126.041 1.782 . . . . 0.0 114.383 -175.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -106.92 -38.16 6.13 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.938 1.695 . . . . 0.0 111.484 171.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.7 m-85 -71.88 -25.33 61.89 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.563 0.745 . . . . 0.0 112.389 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -54.1 -34.51 60.4 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 172.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.42 -45.61 72.12 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.698 0.799 . . . . 0.0 111.883 177.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -54.72 -46.32 74.19 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 118.544 -0.741 . . . . 0.0 110.632 169.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -57.79 -46.11 85.08 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 119.433 1.015 . . . . 0.0 113.716 175.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -58.27 -42.08 85.69 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.264 0.938 . . . . 0.0 111.225 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.39 -35.47 58.6 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -178.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -64.56 -52.01 59.84 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 125.036 1.334 . . . . 0.0 111.532 174.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.6 ttpp -50.18 -53.12 30.04 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.97 0.908 . . . . 0.0 112.069 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 27.1 pttt -60.92 -46.56 90.17 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.515 0.932 . . . . 0.0 113.515 174.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -56.61 -49.37 75.14 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.221 1.008 . . . . 0.0 112.445 177.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -64.4 -52.36 58.6 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 125.572 1.549 . . . . 0.0 113.141 176.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -55.07 -34.83 63.94 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 118.585 -0.722 . . . . 0.0 112.143 173.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.27 -51.61 29.2 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.067 0.849 . . . . 0.0 111.778 178.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -58.62 -49.32 77.91 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.899 0.879 . . . . 0.0 111.469 176.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -64.3 -50.03 69.45 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.609 1.163 . . . . 0.0 112.2 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.03 -44.48 91.75 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.177 0.898 . . . . 0.0 111.87 176.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -65.07 -50.42 66.23 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.465 0.706 . . . . 0.0 111.882 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -53.72 -51.2 64.06 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.438 1.095 . . . . 0.0 110.557 172.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.05 -41.04 95.84 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.802 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.86 -50.65 72.96 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.338 1.055 . . . . 0.0 111.999 176.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.42 -47.76 84.28 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.754 0.822 . . . . 0.0 112.635 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -59.68 -51.14 71.06 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.944 0.897 . . . . 0.0 110.687 177.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -46.71 68.14 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.401 1.88 . . . . 0.0 112.968 174.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -54.79 -52.57 62.21 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.187 0.995 . . . . 0.0 112.388 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.99 -30.45 69.71 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 177.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 73.8 t -72.97 -22.57 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.808 1.643 . . . . 0.0 113.153 176.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.65 -30.53 63.44 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 176.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -87.53 0.17 55.96 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.295 1.438 . . . . 0.0 114.554 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.9 tpp -97.09 -162.12 0.93 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.193 1.797 . . . . 0.0 111.844 -177.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -53.41 154.85 5.7 Favored Pre-proline 0 N--CA 1.477 0.908 0 C-N-CA 126.768 2.027 . . . . 0.0 113.546 171.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -70.13 -43.99 2.06 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.389 2.726 . . . . 0.0 112.41 -177.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -62.45 -28.09 69.57 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.018 0.927 . . . . 0.0 113.26 176.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.33 -48.61 79.05 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.877 -0.514 . . . . 0.0 110.981 177.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.34 -41.26 60.45 Favored 'General case' 0 N--CA 1.482 1.158 0 O-C-N 121.492 -0.755 . . . . 0.0 111.678 173.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.413 ' HB3' ' HB1' ' A' ' 106' ' ' ALA . 66.0 mmtt -61.75 -50.32 72.87 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.484 1.514 . . . . 0.0 111.433 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.93 -46.09 89.43 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-O 121.938 0.875 . . . . 0.0 113.079 177.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -65.75 -41.12 92.5 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 120.729 -1.232 . . . . 0.0 112.369 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.62 -38.89 89.28 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 117.826 -1.083 . . . . 0.0 112.277 171.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.61 ' HB2' HD13 ' A' ' 103' ' ' ILE . 6.6 tm-20 -55.24 -53.36 56.99 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.355 1.434 . . . . 0.0 111.593 170.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.14 -36.2 83.26 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-O 121.159 0.504 . . . . 0.0 112.061 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 2.5 t -73.49 -40.64 63.94 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.188 -0.945 . . . . 0.0 112.403 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.68 -49.48 58.65 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 117.901 -1.047 . . . . 0.0 109.433 174.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.1 tp -66.48 -29.66 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 119.873 1.215 . . . . 0.0 113.241 -175.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.15 -17.11 62.56 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 173.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -109.82 -28.26 8.87 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.852 1.661 . . . . 0.0 113.146 -178.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.53 147.02 24.0 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 127.363 2.265 . . . . 0.0 111.767 178.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -102.92 -44.96 5.1 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.924 1.29 . . . . 0.0 112.953 170.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t -124.05 -5.07 7.93 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.05 84.27 5.81 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.726 1.61 . . . . 0.0 110.914 -176.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 14.1 p30 -65.12 169.42 5.5 Favored 'General case' 0 CA--C 1.55 0.944 0 O-C-N 121.048 -1.032 . . . . 0.0 112.156 175.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 158.95 -12.41 0.2 Allowed Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.093 0.854 . . . . 0.0 114.411 -178.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.61 HD13 ' HB2' ' A' ' 90' ' ' GLU . 1.8 tp -54.54 -48.17 70.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-N 118.691 1.246 . . . . 0.0 112.184 168.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -43.48 -45.9 6.63 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -55.96 -59.4 4.96 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.876 1.27 . . . . 0.0 111.237 171.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.413 ' HB1' ' HB3' ' A' ' 86' ' ' LYS . . . -57.09 -38.28 73.11 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.177 0.991 . . . . 0.0 113.411 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.33 -49.16 78.71 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 126.327 1.851 . . . . 0.0 111.031 174.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.5 mttm -54.69 -48.2 72.72 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 118.046 -0.978 . . . . 0.0 111.6 173.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.6 mm -56.67 -48.66 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 CA-C-N 119.026 0.83 . . . . 0.0 111.462 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -58.73 -47.52 84.33 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.188 0.449 . . . . 0.0 111.579 177.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.81 -49.03 79.11 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.153 1.381 . . . . 0.0 112.075 -176.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.8 pt -68.81 -29.56 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 121.385 -0.822 . . . . 0.0 111.909 173.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -71.67 -30.92 66.25 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 119.529 1.059 . . . . 0.0 113.495 176.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.466 ' HG3' HG23 ' A' ' 115' ' ' THR . 6.2 ptmt -83.97 -16.95 42.2 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 119.278 0.944 . . . . 0.0 113.305 172.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.466 HG23 ' HG3' ' A' ' 114' ' ' LYS . 71.1 p -121.48 20.69 11.14 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.873 1.669 . . . . 0.0 113.869 -177.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.75 151.16 0.63 Allowed Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 126.934 2.093 . . . . 0.0 114.051 176.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -66.84 157.09 63.04 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 121.81 1.673 . . . . 0.0 111.737 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 29.2 tp60 -63.58 -23.7 67.5 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.367 -0.833 . . . . 0.0 112.219 177.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.1 t -61.86 -51.52 67.88 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.2 1.4 . . . . 0.0 112.184 178.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.9 p -69.06 -37.02 76.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 O-C-N 121.72 -0.612 . . . . 0.0 111.561 175.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -60.22 -47.89 84.07 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.917 173.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -68.3 -39.66 81.98 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.458 1.027 . . . . 0.0 112.928 177.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.61 -37.09 82.03 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.097 -1.002 . . . . 0.0 112.246 177.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -85.89 -20.13 29.51 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.309 1.044 . . . . 0.0 113.571 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.95 -33.8 57.87 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.001 1.72 . . . . 0.0 112.574 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.53 -36.89 68.42 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.626 1.171 . . . . 0.0 112.365 173.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -75.42 -163.06 11.76 Favored Glycine 0 CA--C 1.538 1.517 0 C-N-CA 126.633 2.063 . . . . 0.0 113.427 172.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -136.25 64.64 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 125.426 1.491 . . . . 0.0 111.946 -167.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 49.67 74.82 0.24 Allowed Glycine 0 CA--C 1.54 1.63 0 C-N-CA 125.646 1.593 . . . . 0.0 113.413 -176.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -69.84 164.93 32.77 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.469 2.779 . . . . 0.0 112.548 -176.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -149.74 108.19 3.8 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.073 1.349 . . . . 0.0 110.736 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 7.0 t -126.31 75.71 73.14 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.878 1.271 . . . . 0.0 109.805 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -71.18 176.19 8.19 Favored 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.509 2.806 . . . . 0.0 112.124 174.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 . . . . . 0 C--O 1.253 1.272 0 C-N-CA 124.417 1.087 . . . . 0.0 112.798 173.423 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 123.026 1.393 . . . . 0.0 114.333 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -148.61 130.61 15.31 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.266 1.826 . . . . 0.0 110.908 178.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -63.46 158.83 55.57 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 124.196 0.998 . . . . 0.0 112.082 171.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -66.89 164.95 27.69 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.856 2.371 . . . . 0.0 111.579 178.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -64.41 115.65 3.31 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 122.99 2.46 . . . . 0.0 111.419 175.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -71.95 -20.47 25.6 Favored 'Trans proline' 0 CA--C 1.55 1.28 0 CA-C-O 115.652 -1.895 . . . . 0.0 116.121 167.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.36 166.5 29.1 Favored 'Trans proline' 0 C--N 1.363 1.303 0 CA-C-N 124.427 2.617 . . . . 0.0 112.219 176.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -59.16 132.37 46.58 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.859 2.372 . . . . 0.0 111.361 169.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -49.82 -46.47 51.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.273 0.629 . . . . 0.0 110.848 169.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.727 ' H ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -93.4 35.44 1.1 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.93 2.492 . . . . 0.0 113.785 -179.606 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.12 110.75 0.19 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.497 1.519 . . . . 0.0 113.864 176.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.46 18.08 0.28 Allowed Glycine 0 CA--C 1.539 1.588 0 C-N-CA 125.453 1.501 . . . . 0.0 115.717 -174.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.4 160.84 38.09 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 125.857 1.663 . . . . 0.0 112.667 -170.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.09 170.35 20.58 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.504 2.803 . . . . 0.0 113.298 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -53.75 -35.24 61.02 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -179.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.49 -40.53 65.44 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.325 1.45 . . . . 0.0 112.692 173.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.5 t -81.45 -45.27 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 C-N-CA 125.398 1.479 . . . . 0.0 112.203 174.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 92.8 t -54.64 -38.6 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 123.573 0.749 . . . . 0.0 111.07 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -63.35 -50.6 69.35 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.202 -0.936 . . . . 0.0 112.084 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.41 -48.65 71.37 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.018 0.827 . . . . 0.0 112.356 176.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.11 -53.69 39.47 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.719 1.208 . . . . 0.0 111.597 171.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -62.96 -47.52 82.82 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -59.33 -41.36 88.96 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.583 1.153 . . . . 0.0 110.888 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.6 tp -60.91 -52.01 66.84 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 122.575 0.35 . . . . 0.0 111.306 169.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.45 -33.78 68.3 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 178.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -55.14 -35.16 64.43 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 120.449 1.477 . . . . 0.0 113.319 177.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -72.81 -25.26 61.08 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.993 1.317 . . . . 0.0 113.277 172.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -109.83 14.11 23.31 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 126.216 1.806 . . . . 0.0 113.488 -174.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -21.05 60.18 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.289 -1.507 . . . . 0.0 113.814 -171.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.6 p -109.22 2.47 20.95 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.474 2.31 . . . . 0.0 114.316 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -76.56 170.81 15.72 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.064 1.745 . . . . 0.0 111.906 176.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.404 HG22 ' H ' ' A' ' 33' ' ' ASP . 0.2 OUTLIER -84.51 172.02 12.02 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.768 1.227 . . . . 0.0 112.307 173.7 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.404 ' H ' HG22 ' A' ' 32' ' ' THR . 21.6 t0 -49.45 -63.5 1.66 Allowed Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 127.294 2.238 . . . . 0.0 112.302 173.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -62.21 -32.47 82.57 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 122.755 2.303 . . . . 0.0 113.328 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -64.65 -51.16 64.04 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.679 0.792 . . . . 0.0 111.885 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 50.8 mt -64.74 -52.52 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 124.291 1.036 . . . . 0.0 110.028 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -47.7 -52.05 19.69 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.25 1.82 . . . . 0.0 112.706 178.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -57.71 -44.29 85.8 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.306 0.957 . . . . 0.0 112.702 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.67 -43.29 97.13 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.191 0.997 . . . . 0.0 112.67 174.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.74 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.7 mm? -58.72 -48.98 79.28 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.19 1.396 . . . . 0.0 111.75 173.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -62.95 -37.66 87.96 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 177.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.3 -48.87 73.47 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.74 ' HE1' HD13 ' A' ' 40' ' ' LEU . 7.2 p-90 -73.88 -34.0 64.26 Favored 'General case' 0 CA--C 1.553 1.078 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 173.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.46 HG23 HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -57.82 -32.46 43.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 124.724 1.21 . . . . 0.0 112.485 173.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.39 -15.78 29.4 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 118.677 0.671 . . . . 0.0 112.733 177.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 42.2 m -94.57 -21.44 18.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.947 1.299 . . . . 0.0 113.057 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.577 HD11 ' CH2' ' A' ' 43' ' ' TRP . 24.9 mt -59.4 -63.33 1.34 Allowed 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.23 93.31 0.41 Allowed Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.031 0.824 . . . . 0.0 112.485 -178.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 178.61 -163.5 31.39 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 124.962 1.268 . . . . 0.0 112.22 -177.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -57.37 -16.82 10.01 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.612 1.165 . . . . 0.0 113.911 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -54.18 -21.3 8.52 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.942 2.097 . . . . 0.0 113.887 172.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -36.03 66.78 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.837 1.655 . . . . 0.0 113.904 170.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.78 -39.87 84.03 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.933 0.873 . . . . 0.0 110.803 175.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -60.24 -39.66 87.49 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 117.513 -1.232 . . . . 0.0 112.31 169.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -60.23 -54.08 50.02 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 121.069 1.759 . . . . 0.0 113.09 171.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -58.59 -40.34 82.93 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.57 -0.706 . . . . 0.0 111.561 -177.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.07 -31.72 58.92 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 177.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -51.87 64.43 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.392 1.477 . . . . 0.0 111.132 171.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.9 ttmm -53.91 -50.03 67.3 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.267 0.354 . . . . 0.0 110.427 -175.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.3 mttt -62.04 -49.46 75.92 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.552 1.141 . . . . 0.0 113.746 172.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -52.18 -50.92 60.91 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.491 1.496 . . . . 0.0 112.114 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 13.2 mmt -73.84 -45.14 52.98 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.97 -35.24 70.91 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.373 0.533 . . . . 0.0 112.011 173.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.65 -50.59 35.12 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.754 1.222 . . . . 0.0 111.263 176.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.8 tptt -55.74 -53.26 58.8 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.783 0.719 . . . . 0.0 110.351 177.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -60.04 -51.73 68.41 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.923 1.289 . . . . 0.0 111.991 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.16 -45.8 93.15 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.599 1.09 . . . . 0.0 113.081 177.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -65.64 -46.65 78.42 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.731 0.813 . . . . 0.0 111.721 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 48.7 mt -57.69 -51.13 70.8 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.365 1.066 . . . . 0.0 111.014 172.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.31 -44.52 88.62 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.705 0.802 . . . . 0.0 112.142 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -59.43 -50.92 72.08 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.329 1.052 . . . . 0.0 112.277 176.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.91 -47.88 84.37 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.835 0.854 . . . . 0.0 112.775 176.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -55.98 -54.21 47.61 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.844 0.858 . . . . 0.0 111.367 173.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.35 -42.27 77.49 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 119.75 1.159 . . . . 0.0 112.781 179.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.21 -52.49 64.23 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.416 1.086 . . . . 0.0 112.559 171.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.91 -30.72 70.95 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 176.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 52.9 t -73.09 -25.06 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 126.407 1.883 . . . . 0.0 113.003 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.91 -30.86 66.24 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 177.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.7 pttt -86.68 0.2 55.04 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.168 1.387 . . . . 0.0 114.277 173.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.7 ttm -102.3 -160.3 0.78 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.67 1.988 . . . . 0.0 111.822 -173.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.18 156.12 22.47 Favored Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 125.391 1.476 . . . . 0.0 113.757 177.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.06 -46.19 1.62 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.415 2.743 . . . . 0.0 112.858 -176.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.71 -32.22 70.32 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.153 0.981 . . . . 0.0 112.463 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.72 -49.0 72.56 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.231 0.613 . . . . 0.0 109.96 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -54.33 -43.47 71.25 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 118.564 -0.731 . . . . 0.0 111.464 173.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -59.25 -54.71 43.76 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.255 0.934 . . . . 0.0 110.871 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.77 -49.01 79.24 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 177.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -70.37 -35.79 73.74 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.93 -44.71 88.6 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.906 1.23 . . . . 0.0 111.24 172.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -44.66 82.55 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.824 0.85 . . . . 0.0 111.883 172.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.73 -36.49 83.75 Favored 'General case' 0 CA--C 1.547 0.861 0 O-C-N 121.504 -0.748 . . . . 0.0 112.721 173.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.1 t -72.22 -37.63 69.16 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.786 -1.196 . . . . 0.0 112.644 -177.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -71.08 -51.4 25.4 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 118.911 -0.566 . . . . 0.0 110.032 173.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.5 tt -63.41 -29.77 48.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-N 119.111 0.869 . . . . 0.0 112.881 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.43 -24.2 63.3 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 177.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -110.68 -26.19 9.55 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.473 1.109 . . . . 0.0 113.758 170.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -111.3 81.04 1.38 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.665 1.586 . . . . 0.0 112.078 -174.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -13.11 48.85 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.933 1.293 . . . . 0.0 114.48 176.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 62.2 m -70.64 -18.28 62.86 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 176.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 22.4 mt -85.76 84.21 7.63 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.569 1.148 . . . . 0.0 109.874 176.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 51.6 m-20 -88.6 155.7 19.47 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.874 0.87 . . . . 0.0 111.459 172.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 74.96 12.83 83.07 Favored Glycine 0 CA--C 1.534 1.239 0 CA-C-O 118.964 -0.909 . . . . 0.0 115.223 -178.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.473 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.2 OUTLIER -58.42 -24.23 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 CA-C-N 119.312 1.556 . . . . 0.0 113.361 -174.085 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -47.49 -36.7 10.58 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.56 1.144 . . . . 0.0 113.283 171.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.9 mttt -60.47 -59.42 5.43 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.028 0.831 . . . . 0.0 111.238 173.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.473 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.55 -37.44 87.55 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.036 0.835 . . . . 0.0 111.942 -175.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.6 tm0? -53.27 -51.66 61.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.2 1.0 . . . . 0.0 110.892 171.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -59.51 -49.22 78.62 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 118.05 -0.976 . . . . 0.0 112.57 176.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 33.9 mm -50.74 -48.57 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.64 1.176 . . . . 0.0 110.947 174.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -66.8 -43.26 84.32 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 121.286 -0.884 . . . . 0.0 112.194 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.51 -42.52 92.43 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.524 1.129 . . . . 0.0 112.636 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.7 pp -74.86 -40.12 45.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 O-C-N 121.685 -0.634 . . . . 0.0 111.861 172.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -59.41 -29.87 68.06 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.731 1.213 . . . . 0.0 113.427 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.3 -17.94 14.39 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 175.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.9 t -59.46 -21.81 60.61 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.999 1.32 . . . . 0.0 113.55 177.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 40.6 mt -54.92 152.09 14.37 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.081 1.353 . . . . 0.0 112.736 174.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.04 156.18 66.8 Favored 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 122.528 2.152 . . . . 0.0 112.584 -176.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -59.22 -22.09 60.52 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 11.2 t -64.17 -51.7 62.56 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.538 1.063 . . . . 0.0 111.793 174.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.9 p -73.88 -38.01 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 O-C-N 121.7 -0.625 . . . . 0.0 111.502 178.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 mmmt -58.11 -49.5 76.73 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 118.521 -0.752 . . . . 0.0 111.896 172.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -68.2 -39.3 82.48 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.701 1.137 . . . . 0.0 113.388 178.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -67.23 -34.72 78.06 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 119.474 1.034 . . . . 0.0 112.641 177.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.51 -21.4 26.98 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.095 0.958 . . . . 0.0 113.148 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.11 -14.97 4.45 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.392 1.477 . . . . 0.0 113.909 177.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.421 ' HA ' ' HE2' ' A' ' 126' ' ' LYS . 2.3 mmpt? -62.79 -17.86 61.81 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 167.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -110.27 93.2 0.73 Allowed Glycine 0 CA--C 1.534 1.242 0 C-N-CA 126.005 1.764 . . . . 0.0 112.847 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -130.59 60.26 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.695 1.598 . . . . 0.0 112.623 -174.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 54.01 74.96 0.26 Allowed Glycine 0 CA--C 1.541 1.661 0 C-N-CA 125.469 1.509 . . . . 0.0 113.283 -177.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -70.9 92.45 0.62 Allowed 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 124.35 3.367 . . . . 0.0 113.216 -171.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -163.56 121.87 1.94 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 127.481 2.312 . . . . 0.0 109.962 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 42.8 t -116.47 130.16 24.71 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 125.786 1.634 . . . . 0.0 110.028 176.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -70.94 170.3 18.33 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.442 2.761 . . . . 0.0 112.914 178.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 . . . . . 0 C--O 1.254 1.304 0 C-N-CA 124.6 1.16 . . . . 0.0 112.819 179.205 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 . . . . . 0 CA--C 1.545 0.758 0 CA-C-O 121.312 0.577 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -152.12 117.5 5.3 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 125.011 1.324 . . . . 0.0 109.717 176.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -61.28 155.85 54.47 Favored Pre-proline 0 N--CA 1.472 0.638 0 C-N-CA 123.39 0.676 . . . . 0.0 111.955 171.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -68.77 170.4 15.43 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 123.052 2.501 . . . . 0.0 112.379 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -64.84 116.19 3.68 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.03 2.487 . . . . 0.0 111.491 176.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -70.32 -22.53 29.39 Favored 'Trans proline' 0 CA--C 1.552 1.402 0 CA-C-O 115.727 -1.864 . . . . 0.0 115.817 163.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.93 169.32 19.4 Favored 'Trans proline' 0 C--N 1.363 1.309 0 CA-C-N 124.222 2.544 . . . . 0.0 112.484 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -59.86 129.3 29.95 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.398 2.065 . . . . 0.0 110.357 171.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -47.67 -47.86 29.29 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.141 0.576 . . . . 0.0 110.964 170.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.755 ' H ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -91.56 38.77 0.99 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 128.997 2.919 . . . . 0.0 114.242 177.293 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.5 112.69 0.41 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.511 1.125 . . . . 0.0 113.609 174.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 143.65 -12.86 2.21 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.958 1.742 . . . . 0.0 114.616 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.31 161.29 75.45 Favored Pre-proline 0 CA--C 1.558 1.281 0 C-N-CA 125.342 1.457 . . . . 0.0 113.706 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -75.7 172.72 15.77 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.913 3.075 . . . . 0.0 113.675 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -53.31 -37.76 62.56 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.851 1.261 . . . . 0.0 113.821 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -53.24 -41.14 65.14 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.024 1.33 . . . . 0.0 112.696 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.6 t -80.47 -42.23 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 124.599 1.16 . . . . 0.0 111.983 174.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.8 t -54.81 -39.31 47.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-N 118.593 0.633 . . . . 0.0 110.688 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.3 tptm -61.16 -50.65 72.29 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.079 -1.013 . . . . 0.0 112.137 174.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.6 -50.4 68.15 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.177 0.591 . . . . 0.0 111.816 176.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.44 -50.58 59.47 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.807 0.843 . . . . 0.0 111.9 170.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.15 -47.45 85.86 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.285 0.948 . . . . 0.0 112.819 -176.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -70.96 -32.28 69.1 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.949 -0.47 . . . . 0.0 111.899 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.3 tp -64.35 -49.15 72.81 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.775 0.83 . . . . 0.0 111.516 170.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -66.53 -29.51 69.62 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.926 1.29 . . . . 0.0 114.448 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.6 mttm -54.7 -51.84 64.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 120.062 1.301 . . . . 0.0 112.833 176.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.95 -17.93 64.59 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.561 1.144 . . . . 0.0 113.687 173.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -108.79 18.65 20.55 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.543 1.937 . . . . 0.0 113.693 -179.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.09 -20.46 65.98 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 120.18 -1.575 . . . . 0.0 113.512 -176.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.2 m -103.51 6.76 37.65 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 126.859 2.064 . . . . 0.0 112.991 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -73.73 -172.55 1.28 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.503 1.521 . . . . 0.0 112.704 173.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 m -123.48 170.44 10.38 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 128.098 2.559 . . . . 0.0 110.453 -178.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -44.7 -56.78 7.89 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.849 1.659 . . . . 0.0 112.637 175.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -68.82 -41.99 5.03 Favored 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 122.212 1.941 . . . . 0.0 113.072 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.53 -41.56 94.68 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.379 -1.451 . . . . 0.0 112.654 -178.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 64.3 mt -69.46 -53.43 24.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 123.588 0.755 . . . . 0.0 109.641 174.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -58.63 -35.39 72.42 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.037 0.835 . . . . 0.0 111.662 -174.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -54.31 -60.9 2.72 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.337 1.455 . . . . 0.0 112.579 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.6 -36.88 85.26 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.074 0.549 . . . . 0.0 112.078 -178.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.594 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.4 mm? -63.06 -48.97 76.39 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.437 1.095 . . . . 0.0 111.574 174.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -65.23 -34.13 77.63 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 121.568 -0.708 . . . . 0.0 112.363 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.22 -50.87 66.12 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.454 -0.779 . . . . 0.0 112.574 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.594 ' HE1' HD13 ' A' ' 40' ' ' LEU . 7.8 p-90 -73.88 -31.33 63.08 Favored 'General case' 0 CA--C 1.557 1.249 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 170.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.499 HG23 HD12 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -59.46 -32.48 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 O-C-N 120.243 -1.536 . . . . 0.0 111.813 174.136 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -59.2 -18.62 38.23 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.583 -0.698 . . . . 0.0 112.366 176.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -97.61 -13.59 21.48 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.861 1.264 . . . . 0.0 113.237 177.005 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.549 HD11 ' CH2' ' A' ' 43' ' ' TRP . 22.0 mt -62.22 -64.75 0.83 Allowed 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.048 0.84 . . . . 0.0 112.667 174.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.4 117.37 2.64 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.378 0.99 . . . . 0.0 111.657 -177.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 157.22 -169.2 34.23 Favored Glycine 0 CA--C 1.529 0.954 0 C-N-CA 124.922 1.249 . . . . 0.0 112.575 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -59.4 -15.36 16.42 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.336 1.054 . . . . 0.0 113.313 176.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -50.37 -29.38 9.89 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.697 1.999 . . . . 0.0 113.997 174.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.08 -35.8 64.95 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.163 1.385 . . . . 0.0 114.129 172.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.4 -39.54 81.63 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.122 -0.986 . . . . 0.0 111.209 175.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.06 -33.08 75.18 Favored 'General case' 0 C--O 1.22 -0.466 0 O-C-N 121.742 -0.599 . . . . 0.0 110.473 176.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -63.19 -53.22 56.6 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 121.484 -0.76 . . . . 0.0 111.534 173.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.59 -40.56 79.32 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -177.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.3 t -72.17 -39.14 68.89 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -61.52 -52.33 64.93 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.394 -0.816 . . . . 0.0 111.952 176.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 3.3 ttmm -47.88 -46.27 31.33 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 118.329 0.513 . . . . 0.0 111.197 177.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -60.1 -57.17 13.99 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.012 1.325 . . . . 0.0 113.591 173.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -54.16 -49.75 68.57 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.302 0.956 . . . . 0.0 112.301 178.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.02 -48.53 73.58 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.383 1.073 . . . . 0.0 112.075 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -54.73 -39.99 68.8 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.517 0.727 . . . . 0.0 111.556 172.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.25 -51.17 56.34 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.798 0.726 . . . . 0.0 111.454 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -60.35 -48.16 82.96 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.73 0.812 . . . . 0.0 111.027 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -61.24 -49.83 75.53 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.067 1.347 . . . . 0.0 112.089 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.82 -51.63 68.22 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.788 1.176 . . . . 0.0 112.86 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -62.78 -48.36 79.49 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.811 -0.556 . . . . 0.0 112.465 178.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.1 tp -54.46 -51.24 65.63 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.184 0.994 . . . . 0.0 110.955 174.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.78 -42.92 99.61 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.581 1.152 . . . . 0.0 112.072 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -58.17 -50.84 72.11 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.824 1.193 . . . . 0.0 111.466 174.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.34 -47.86 80.42 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.762 0.825 . . . . 0.0 112.713 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -54.5 -56.29 20.37 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.209 1.004 . . . . 0.0 111.068 172.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.82 -40.81 73.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.519 1.128 . . . . 0.0 113.205 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -58.51 -52.54 65.2 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 171.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.19 -29.76 70.09 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 176.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.6 t -73.13 -26.66 23.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 125.868 1.667 . . . . 0.0 112.678 175.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.56 -34.32 64.64 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.5 pttt -85.03 1.71 46.46 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.286 1.435 . . . . 0.0 114.347 175.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.7 ttm -103.25 -159.27 0.71 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.985 2.114 . . . . 0.0 111.695 -174.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.74 156.71 11.81 Favored Pre-proline 0 N--CA 1.479 1.003 0 C-N-CA 125.283 1.433 . . . . 0.0 113.864 176.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -69.43 -45.54 1.73 Allowed 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.448 2.765 . . . . 0.0 112.803 -177.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -61.3 -30.71 70.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.147 0.979 . . . . 0.0 112.438 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.76 -48.44 71.82 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.837 0.455 . . . . 0.0 110.23 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.19 -44.62 68.07 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.385 173.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm -59.53 -54.77 42.68 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.034 0.833 . . . . 0.0 110.863 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.08 -49.14 78.81 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.698 -0.626 . . . . 0.0 112.481 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -66.55 -32.94 74.61 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.05 -46.57 80.68 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.663 1.119 . . . . 0.0 111.577 172.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -56.91 -47.06 81.45 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 118.891 0.769 . . . . 0.0 111.662 172.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.6 tp -63.06 -38.75 92.44 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 176.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 21.7 t -71.13 -42.97 68.52 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.69 -1.256 . . . . 0.0 112.256 -178.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.38 -46.11 70.92 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 118.666 -0.683 . . . . 0.0 110.624 175.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.3 tp -66.47 -33.72 65.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 119.263 0.938 . . . . 0.0 111.717 -178.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.04 -32.77 74.45 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -94.31 -28.14 15.73 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 173.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -132.95 78.1 1.77 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.192 1.397 . . . . 0.0 110.964 -172.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -69.88 -32.26 70.52 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.777 -1.202 . . . . 0.0 112.254 -177.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 12.6 t -73.74 -18.81 60.94 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.421 1.489 . . . . 0.0 113.875 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -94.51 84.44 4.32 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 124.201 1.0 . . . . 0.0 109.266 178.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -92.33 158.17 16.24 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.995 0.918 . . . . 0.0 110.895 170.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 159.34 -87.05 0.11 Allowed Glycine 0 N--CA 1.468 0.811 0 C-N-CA 124.667 1.127 . . . . 0.0 111.79 178.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.411 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -55.63 -31.72 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 CA-C-N 118.067 0.934 . . . . 0.0 111.889 179.757 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -46.93 -37.72 9.41 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.873 1.269 . . . . 0.0 113.429 -178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -61.1 -59.42 5.37 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.864 0.866 . . . . 0.0 110.947 172.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.411 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -63.81 -33.63 76.1 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.794 0.724 . . . . 0.0 112.285 -177.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.07 -50.99 71.96 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.83 1.252 . . . . 0.0 111.426 173.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.9 -48.47 79.79 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.111 0.964 . . . . 0.0 111.03 173.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 18.4 mm -53.31 -50.59 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 124.378 1.071 . . . . 0.0 111.322 176.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -63.13 -44.44 95.56 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.779 1.172 . . . . 0.0 112.887 176.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.81 -49.0 78.1 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.077 0.951 . . . . 0.0 110.784 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.4 pt -70.49 -38.86 75.2 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 CA-C-O 118.243 -0.884 . . . . 0.0 112.629 173.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -58.17 -39.57 79.23 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 121.006 1.73 . . . . 0.0 113.075 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -67.1 -14.76 63.21 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.824 1.25 . . . . 0.0 113.562 173.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 5.0 t -132.56 33.34 3.79 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.798 2.039 . . . . 0.0 113.513 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 8.9 mt -108.04 74.86 0.51 Allowed Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 126.174 1.789 . . . . 0.0 109.966 175.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.98 168.39 19.01 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.95 2.433 . . . . 0.0 111.904 173.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -60.53 -27.33 67.54 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.401 -0.812 . . . . 0.0 113.036 173.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 65.6 m -60.46 -51.71 68.32 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.435 1.471 . . . . 0.0 112.381 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.461 HG22 HD23 ' A' ' 124' ' ' LEU . 14.8 p -68.56 -40.15 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.811 -0.556 . . . . 0.0 111.638 175.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 mmtt -58.16 -48.1 81.33 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.502 174.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -69.05 -38.17 78.95 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.674 1.125 . . . . 0.0 113.444 177.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -69.29 -37.09 77.66 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.605 1.093 . . . . 0.0 112.326 177.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.461 HD23 HG22 ' A' ' 120' ' ' VAL . 0.5 OUTLIER -85.83 -20.82 28.57 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.682 1.193 . . . . 0.0 113.132 179.413 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.25 -24.1 10.46 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 126.605 1.962 . . . . 0.0 113.601 177.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.6 tptt -55.66 -29.57 59.53 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.178 1.391 . . . . 0.0 113.371 171.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 85.48 -140.71 18.41 Favored Glycine 0 CA--C 1.534 1.281 0 C-N-CA 125.518 1.533 . . . . 0.0 112.844 -176.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -118.98 64.93 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 126.723 2.009 . . . . 0.0 111.042 -170.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 50.08 74.71 0.25 Allowed Glycine 0 CA--C 1.541 1.672 0 C-N-CA 125.871 1.701 . . . . 0.0 113.352 -174.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -68.52 161.88 43.19 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.42 2.746 . . . . 0.0 112.566 -176.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -143.05 97.91 3.18 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.937 1.295 . . . . 0.0 111.197 -177.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 38.8 t -134.85 131.85 20.22 Favored Pre-proline 0 N--CA 1.478 0.965 0 C-N-CA 125.339 1.456 . . . . 0.0 110.121 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -69.86 174.7 9.21 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 123.779 2.986 . . . . 0.0 113.081 176.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 . . . . . 0 C--O 1.25 1.124 0 C-N-CA 126.025 1.73 . . . . 0.0 113.299 -179.131 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 26.3 t0 . . . . . 0 N--CA 1.478 0.955 0 CA-C-O 122.334 1.064 . . . . 0.0 111.751 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 63.58 13.81 7.57 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 126.36 1.864 . . . . 0.0 114.202 -176.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p -121.93 160.01 48.93 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 128.418 2.687 . . . . 0.0 111.905 -173.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -67.45 168.78 17.1 Favored 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.017 2.478 . . . . 0.0 112.133 176.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -64.79 118.24 5.24 Favored 'Trans proline' 0 CA--C 1.546 1.081 0 C-N-CA 122.602 2.201 . . . . 0.0 111.079 172.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -69.47 -22.8 32.89 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 CA-C-O 115.381 -2.008 . . . . 0.0 115.995 164.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.89 169.9 20.13 Favored 'Trans proline' 0 C--N 1.363 1.333 0 CA-C-N 124.487 2.638 . . . . 0.0 113.451 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -62.21 121.24 9.17 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.18 2.586 . . . . 0.0 111.975 175.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -56.72 -19.14 15.17 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 171.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.401 ' N ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -117.29 36.69 4.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 129.317 3.047 . . . . 0.0 112.415 178.128 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.16 110.89 0.24 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.401 1.48 . . . . 0.0 113.007 175.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.17 13.11 0.2 Allowed Glycine 0 CA--C 1.539 1.578 0 C-N-CA 124.916 1.246 . . . . 0.0 115.766 -174.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -116.76 160.02 38.28 Favored Pre-proline 0 CA--C 1.554 1.114 0 C-N-CA 125.663 1.585 . . . . 0.0 112.67 -170.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -73.82 171.4 17.94 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.423 2.749 . . . . 0.0 113.299 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -55.35 -34.01 63.9 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -53.3 -40.71 64.96 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.249 1.42 . . . . 0.0 112.779 171.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 56.0 t -78.75 -44.18 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 124.508 1.123 . . . . 0.0 111.986 173.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 73.7 t -53.91 -39.52 40.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-N 118.816 0.735 . . . . 0.0 111.211 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 tptm -62.78 -50.45 70.99 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.038 -1.038 . . . . 0.0 112.223 174.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.63 -49.24 71.0 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.258 0.623 . . . . 0.0 111.691 176.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.89 -51.19 58.56 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.29 1.036 . . . . 0.0 111.976 170.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.44 -47.3 86.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.881 1.218 . . . . 0.0 113.312 -177.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -65.7 -40.41 92.25 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.895 -0.503 . . . . 0.0 110.979 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.2 tp -61.66 -46.38 89.99 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.862 0.865 . . . . 0.0 111.524 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -63.16 -40.8 98.58 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.714 -1.241 . . . . 0.0 113.8 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.5 mmtp -56.06 -36.0 67.56 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 119.262 0.937 . . . . 0.0 112.974 174.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.68 -38.35 70.64 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.274 1.43 . . . . 0.0 113.497 173.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -98.3 20.39 12.65 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.538 1.535 . . . . 0.0 113.168 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -66.67 -17.08 64.66 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 119.813 -1.804 . . . . 0.0 113.923 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.0 p -95.35 2.01 54.51 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 127.312 2.245 . . . . 0.0 114.363 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -84.08 179.42 7.51 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.652 1.581 . . . . 0.0 111.163 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.44 170.8 7.73 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.673 1.989 . . . . 0.0 111.068 177.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -47.78 -58.35 7.89 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 124.987 1.315 . . . . 0.0 112.221 175.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.75 -36.85 17.57 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.044 1.829 . . . . 0.0 114.26 178.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.99 -45.08 96.25 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 120.959 -1.088 . . . . 0.0 111.918 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.8 mt -69.46 -48.53 66.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-O 118.665 -0.683 . . . . 0.0 110.552 175.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -52.31 -41.11 62.68 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.244 0.929 . . . . 0.0 111.249 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.64 -50.75 71.3 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.215 1.406 . . . . 0.0 112.63 177.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.09 -43.31 95.62 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.45 0.7 . . . . 0.0 112.278 176.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.705 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.3 mm? -63.26 -48.54 77.74 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.727 0.811 . . . . 0.0 110.525 175.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -60.41 -31.27 70.22 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 176.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.16 -51.75 68.67 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.437 -0.789 . . . . 0.0 112.072 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.705 ' HE1' HD13 ' A' ' 40' ' ' LEU . 15.8 p-90 -73.84 -31.22 63.1 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 112.986 0.735 . . . . 0.0 112.986 173.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.422 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -57.82 -32.89 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 125.6 1.56 . . . . 0.0 112.993 174.45 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -57.77 -15.75 9.1 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.24 -14.84 18.3 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.469 1.507 . . . . 0.0 113.549 176.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.661 HD11 ' CH2' ' A' ' 43' ' ' TRP . 23.4 mt -65.99 -58.04 6.43 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 176.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 75.07 44.7 22.69 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 123.803 0.716 . . . . 0.0 114.712 -177.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -124.96 47.83 1.0 Allowed Glycine 0 N--CA 1.475 1.26 0 C-N-CA 126.178 1.847 . . . . 0.0 113.832 -178.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 69.7 -1.94 2.13 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 128.388 2.675 . . . . 0.0 114.328 -175.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -65.09 -21.31 66.79 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.394 1.478 . . . . 0.0 114.307 -178.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.61 -36.38 56.24 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.674 1.59 . . . . 0.0 113.423 173.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.48 -43.99 75.75 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.66 0.784 . . . . 0.0 111.511 177.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.83 -42.81 94.38 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 118.441 -0.79 . . . . 0.0 111.635 169.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -57.42 -51.87 67.67 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.374 1.443 . . . . 0.0 112.764 175.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.72 -44.85 93.56 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.844 -0.535 . . . . 0.0 112.018 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.2 t -68.35 -38.88 81.91 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 122.816 0.446 . . . . 0.0 112.177 -179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -66.34 -54.62 22.46 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.729 0.811 . . . . 0.0 111.929 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.7 ttpp -52.82 -43.08 65.71 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.514 0.325 . . . . 0.0 111.48 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.5 mmtt -56.99 -54.3 48.26 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.111 1.764 . . . . 0.0 113.464 170.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -53.48 -46.18 69.9 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 119.38 0.991 . . . . 0.0 112.499 175.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -61.47 -53.39 57.04 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 121.522 -0.736 . . . . 0.0 112.437 177.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.8 mmtm -55.74 -35.55 66.29 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.2 1.0 . . . . 0.0 111.817 176.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.12 -51.02 42.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.071 0.948 . . . . 0.0 111.034 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.69 -46.4 89.19 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.694 0.798 . . . . 0.0 111.55 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -62.72 -51.71 66.13 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.675 1.19 . . . . 0.0 112.019 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.11 -46.03 86.23 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.039 0.836 . . . . 0.0 112.432 177.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -63.42 -46.67 85.26 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.038 0.935 . . . . 0.0 112.46 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -56.44 -50.97 70.12 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.223 1.009 . . . . 0.0 111.325 171.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.12 -40.47 89.82 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.248 0.619 . . . . 0.0 111.986 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -61.45 -50.23 73.6 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.764 1.226 . . . . 0.0 111.668 175.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.68 -47.05 85.81 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.542 0.61 . . . . 0.0 112.332 177.055 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.433 ' O ' HG23 ' A' ' 77' ' ' VAL . 0.7 OUTLIER -57.24 -53.56 56.71 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.922 0.889 . . . . 0.0 111.26 175.185 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -50.82 -45.69 59.63 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.3 1.44 . . . . 0.0 113.155 174.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.3 -50.87 72.09 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.944 1.298 . . . . 0.0 111.973 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.38 -34.14 77.6 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 172.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 73' ' ' HIS . 72.3 t -72.2 -23.46 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 124.927 1.291 . . . . 0.0 112.578 179.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.03 -31.25 60.95 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.68 -1.263 . . . . 0.0 114.382 175.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.93 -2.79 52.55 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.986 1.314 . . . . 0.0 114.298 176.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.21 -160.27 0.79 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.832 2.053 . . . . 0.0 112.036 -174.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -52.57 155.05 4.08 Favored Pre-proline 0 N--CA 1.479 0.985 0 C-N-CA 126.529 1.932 . . . . 0.0 113.485 171.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -67.05 -49.96 1.21 Allowed 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.296 2.664 . . . . 0.0 112.269 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -61.08 -27.76 68.59 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.967 1.307 . . . . 0.0 113.298 178.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.85 -51.96 62.24 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.913 0.485 . . . . 0.0 110.086 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.2 -42.3 66.15 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.265 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.2 mmtm -60.29 -54.73 42.2 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.564 0.62 . . . . 0.0 110.654 -178.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.38 84.04 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.424 0.689 . . . . 0.0 112.788 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.14 -40.51 86.76 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 177.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.96 -48.35 82.05 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.378 1.071 . . . . 0.0 111.074 171.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.63 -43.76 72.55 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.364 1.066 . . . . 0.0 112.057 173.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.455 ' HA ' HG22 ' A' ' 94' ' ' ILE . 0.3 OUTLIER -68.79 -34.59 75.8 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 118.893 0.77 . . . . 0.0 112.866 176.332 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.9 t -71.96 -43.73 64.72 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.754 -1.216 . . . . 0.0 113.016 177.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -35.5 68.91 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.316 1.046 . . . . 0.0 111.705 176.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.455 HG22 ' HA ' ' A' ' 91' ' ' LEU . 5.6 tt -73.05 -32.73 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 119.253 0.933 . . . . 0.0 111.906 175.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.36 -16.66 37.27 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -116.86 8.63 13.62 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.713 1.605 . . . . 0.0 113.566 175.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.74 136.32 56.8 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.101 -0.999 . . . . 0.0 112.39 175.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -103.07 -46.6 4.59 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.391 1.476 . . . . 0.0 112.916 168.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -124.03 -3.48 8.08 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.638 1.575 . . . . 0.0 114.373 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.69 84.31 4.79 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.361 1.465 . . . . 0.0 110.626 -178.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -95.12 160.93 14.33 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.312 1.045 . . . . 0.0 111.68 176.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 76.98 31.78 51.9 Favored Glycine 0 N--CA 1.475 1.237 0 N-CA-C 115.403 0.921 . . . . 0.0 115.403 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.478 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -59.62 -26.96 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 119.339 1.569 . . . . 0.0 113.211 -178.591 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -47.63 -33.87 7.25 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.297 1.439 . . . . 0.0 113.272 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -59.38 -59.57 5.24 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.797 0.839 . . . . 0.0 111.053 171.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.478 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.09 -37.83 88.87 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.19 0.905 . . . . 0.0 111.849 -176.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -53.92 -52.02 61.9 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.67 0.788 . . . . 0.0 111.17 172.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.6 tttt -58.17 -51.78 68.31 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.683 175.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 25.5 mm -49.78 -46.92 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.438 1.095 . . . . 0.0 110.584 178.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -69.16 -42.54 75.78 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.635 0.774 . . . . 0.0 112.795 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.45 -31.99 71.96 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.229 1.412 . . . . 0.0 113.672 174.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 29.3 pt -87.32 -31.31 5.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 119.113 0.869 . . . . 0.0 112.596 171.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.413 ' OH ' HD11 ' A' ' 124' ' ' LEU . 66.2 t80 -62.86 -35.56 80.37 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.843 -1.16 . . . . 0.0 111.911 176.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.11 -21.01 66.37 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.35 -0.844 . . . . 0.0 112.802 175.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 7.3 m -77.9 -26.36 49.04 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.844 1.658 . . . . 0.0 112.55 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 40.1 mt -54.22 152.24 11.71 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 123.467 0.707 . . . . 0.0 112.656 172.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -67.16 159.02 54.12 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.812 2.341 . . . . 0.0 112.474 -176.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -60.35 -24.34 64.99 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 174.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.3 p -63.93 -51.32 64.96 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.691 1.132 . . . . 0.0 112.019 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.4 p -71.88 -39.31 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.853 -0.529 . . . . 0.0 111.576 176.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -56.71 -51.62 68.1 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 118.607 -0.711 . . . . 0.0 112.001 172.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -67.79 -42.38 81.74 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.578 1.081 . . . . 0.0 112.247 -178.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.83 -35.85 81.28 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.115 -0.991 . . . . 0.0 112.546 176.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.413 HD11 ' OH ' ' A' ' 113' ' ' TYR . 0.5 OUTLIER -90.18 -19.41 24.25 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 179.113 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -57.23 -27.89 62.42 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.106 1.762 . . . . 0.0 113.065 176.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 49.9 mmtt -93.59 -4.17 51.33 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.156 1.782 . . . . 0.0 114.144 171.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.09 -112.86 0.82 Allowed Glycine 0 CA--C 1.534 1.231 0 C-N-CA 126.66 2.076 . . . . 0.0 111.291 171.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . 0.267 1.0 OUTLIER 29.37 60.4 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 127.774 2.43 . . . . 0.0 114.677 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 56.32 75.5 0.24 Allowed Glycine 0 CA--C 1.541 1.69 0 C-N-CA 125.502 1.525 . . . . 0.0 113.318 -173.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -71.18 110.2 2.77 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 123.711 2.941 . . . . 0.0 112.686 -171.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -161.94 116.24 1.9 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.886 1.675 . . . . 0.0 110.748 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 39.7 t -97.34 131.96 26.34 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 124.834 1.254 . . . . 0.0 110.219 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -70.56 174.61 9.95 Favored 'Trans proline' 0 CA--C 1.545 1.028 0 C-N-CA 123.728 2.952 . . . . 0.0 113.151 176.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 . . . . . 0 C--O 1.253 1.259 0 C-N-CA 125.159 1.383 . . . . 0.0 113.682 176.678 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 . . . . . 0 CA--C 1.551 0.99 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -62.94 -40.17 96.84 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.483 1.513 . . . . 0.0 114.126 178.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.97 158.1 88.3 Favored Pre-proline 0 N--CA 1.474 0.775 0 C-N-CA 124.984 1.314 . . . . 0.0 112.654 173.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -70.06 162.09 43.51 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 122.642 2.228 . . . . 0.0 111.817 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.85 117.88 4.92 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.859 3.039 . . . . 0.0 111.849 -177.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.14 -21.66 26.93 Favored 'Trans proline' 0 CA--C 1.553 1.467 0 C-N-CA 122.591 2.194 . . . . 0.0 116.654 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.4 167.41 25.36 Favored 'Trans proline' 0 C--N 1.361 1.216 0 CA-C-N 124.241 2.55 . . . . 0.0 112.271 176.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.443 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 33.3 Cg_endo -58.27 133.33 54.43 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.803 2.335 . . . . 0.0 111.752 170.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -49.24 -48.68 45.47 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.397 0.679 . . . . 0.0 111.635 171.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.556 HD23 ' H ' ' A' ' 10' ' ' LEU . 1.6 pt? -81.34 18.1 1.2 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 127.128 2.171 . . . . 0.0 115.03 -178.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.36 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.956 2.102 . . . . 0.0 115.467 -172.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.19 24.22 0.1 Allowed Glycine 0 CA--C 1.538 1.502 0 C-N-CA 124.979 1.276 . . . . 0.0 114.758 -173.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -121.76 157.74 56.31 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 125.856 1.662 . . . . 0.0 111.944 -173.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -73.99 169.14 23.11 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.182 2.588 . . . . 0.0 113.205 -177.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -52.09 -41.06 62.1 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.585 1.554 . . . . 0.0 113.275 -178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -54.22 -42.01 69.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.09 1.356 . . . . 0.0 112.91 173.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.5 t -78.9 -39.24 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.371 1.069 . . . . 0.0 111.503 176.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 46.9 t -57.04 -40.08 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 123.689 0.795 . . . . 0.0 111.098 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.9 tptt -63.02 -50.63 69.94 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.9 -1.125 . . . . 0.0 111.968 174.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -52.84 -48.42 67.02 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.501 0.72 . . . . 0.0 112.232 174.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.443 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 1.5 t80 -50.66 -53.66 29.24 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.593 1.157 . . . . 0.0 111.964 168.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.35 -47.48 85.86 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -62.11 -42.87 99.67 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.541 0.736 . . . . 0.0 111.166 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.4 tp -58.25 -47.7 82.75 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.522 0.729 . . . . 0.0 111.258 172.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -64.39 -30.75 71.79 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -57.89 -29.97 65.49 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 120.392 1.451 . . . . 0.0 113.279 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -46.34 68.59 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.613 1.165 . . . . 0.0 112.105 169.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -94.16 17.68 12.17 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.336 1.854 . . . . 0.0 114.046 -174.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.76 -25.03 66.2 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 120.044 -1.66 . . . . 0.0 113.316 -172.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.2 p -87.51 -0.48 56.89 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.555 1.942 . . . . 0.0 114.284 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.6 mptp? -81.15 161.1 24.2 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.13 1.372 . . . . 0.0 112.245 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -87.15 171.28 10.8 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.749 2.02 . . . . 0.0 111.651 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -41.91 -59.75 2.39 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 127.487 2.315 . . . . 0.0 113.237 172.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.402 ' HB3' ' HG3' ' A' ' 62' ' ' MET . 83.4 Cg_endo -74.06 -31.34 7.99 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 122.048 1.832 . . . . 0.0 113.578 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.69 -42.84 90.76 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.874 -1.141 . . . . 0.0 111.76 177.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.3 mt -65.97 -53.34 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 123.451 0.7 . . . . 0.0 109.824 172.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -56.82 -39.16 73.66 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.262 0.937 . . . . 0.0 112.216 -174.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.1 tttm -59.6 -57.41 13.05 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.575 1.15 . . . . 0.0 112.871 177.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -63.18 -38.04 89.6 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.865 -0.522 . . . . 0.0 111.878 -178.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.672 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.0 OUTLIER -63.12 -48.77 77.12 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.62 1.168 . . . . 0.0 111.402 174.27 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -55.52 -41.19 72.81 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 121.389 -0.819 . . . . 0.0 113.027 173.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.54 -47.56 73.03 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -176.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.675 ' CH2' HD11 ' A' ' 47' ' ' LEU . 7.4 p-90 -73.99 -36.63 64.53 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 114.59 1.329 . . . . 0.0 114.59 168.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.07 -33.37 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 125.363 1.465 . . . . 0.0 112.326 175.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -59.9 -12.42 7.64 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.055 0.942 . . . . 0.0 112.931 177.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.1 m -109.86 -10.7 14.74 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.767 1.627 . . . . 0.0 112.537 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.675 HD11 ' CH2' ' A' ' 43' ' ' TRP . 16.4 mt -66.86 -52.95 37.48 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 173.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -177.06 -166.76 34.49 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 123.678 0.656 . . . . 0.0 112.797 -163.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -123.44 12.08 8.44 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.603 1.573 . . . . 0.0 114.671 -174.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -106.91 -31.45 8.34 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.67 2.388 . . . . 0.0 112.47 173.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -72.78 -22.2 60.87 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.196 0.998 . . . . 0.0 112.698 176.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -33.77 57.85 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.378 1.471 . . . . 0.0 114.359 171.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.1 -40.03 78.62 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.669 0.788 . . . . 0.0 112.074 178.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.19 -46.37 79.42 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 121.15 -0.969 . . . . 0.0 111.173 169.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -58.23 -48.66 79.68 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 174.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -57.23 -42.81 82.12 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.89 0.768 . . . . 0.0 111.183 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.22 -37.06 66.56 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.032 0.533 . . . . 0.0 112.395 -179.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.97 -47.82 78.91 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.501 1.12 . . . . 0.0 113.212 176.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 19.4 ttpp -56.41 -44.32 80.2 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.965 0.906 . . . . 0.0 111.962 177.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 mttm -58.08 -52.73 64.31 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.639 0.776 . . . . 0.0 112.29 169.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -55.94 -41.64 74.94 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.003 0.82 . . . . 0.0 112.91 177.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.402 ' HG3' ' HB3' ' A' ' 34' ' ' PRO . 9.8 tmm? -61.79 -51.32 68.75 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 121.514 -0.741 . . . . 0.0 112.542 175.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -63.82 -28.6 69.97 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.62 0.368 . . . . 0.0 111.399 177.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.43 -51.46 14.87 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.56 1.144 . . . . 0.0 111.916 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.48 -52.67 64.64 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.464 0.575 . . . . 0.0 110.139 174.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.38 -49.19 78.13 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.251 -178.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.36 -46.55 88.15 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.867 1.212 . . . . 0.0 113.064 177.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -66.16 -46.86 75.93 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 118.847 0.749 . . . . 0.0 112.435 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 75.7 mt -57.75 -49.38 76.76 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.463 1.105 . . . . 0.0 110.855 173.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.56 -43.93 96.72 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.188 -0.91 . . . . 0.0 112.233 177.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.7 mtpt -56.21 -50.68 70.57 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.458 1.481 . . . . 0.0 112.421 173.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.49 -51.32 67.92 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 177.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -57.09 -51.99 67.09 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.69 0.796 . . . . 0.0 111.715 175.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.08 -44.62 67.67 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.91 1.284 . . . . 0.0 112.113 176.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -57.18 -52.29 65.9 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.642 0.655 . . . . 0.0 112.583 174.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.31 -30.97 70.95 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 178.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.6 t -72.74 -25.37 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 126.79 2.036 . . . . 0.0 112.913 175.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.44 -30.68 63.15 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.178 1.547 . . . . 0.0 115.178 176.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 pttt -88.73 3.15 51.9 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 125.821 1.648 . . . . 0.0 114.181 172.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 9.1 ttm -106.31 -163.55 0.93 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.695 1.998 . . . . 0.0 111.333 -173.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.15 152.93 20.23 Favored Pre-proline 0 N--CA 1.481 1.091 0 C-N-CA 125.702 1.601 . . . . 0.0 114.209 178.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -68.52 -46.51 1.89 Allowed 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.885 3.057 . . . . 0.0 113.303 -173.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.92 -37.19 71.13 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.411 1.484 . . . . 0.0 112.49 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.0 -46.57 80.88 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.329 0.652 . . . . 0.0 109.828 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -45.39 58.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.418 1.087 . . . . 0.0 111.977 174.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -65.85 -51.62 57.34 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.707 1.203 . . . . 0.0 112.069 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.68 -45.2 92.78 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.167 0.987 . . . . 0.0 113.0 177.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.94 -36.93 70.04 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.065 -1.022 . . . . 0.0 113.234 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.79 97.21 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.496 1.044 . . . . 0.0 111.714 171.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -53.97 -50.51 66.37 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.218 1.407 . . . . 0.0 111.625 170.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 9.6 tp -59.53 -39.69 84.72 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 174.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.5 t -72.62 -38.36 67.8 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.189 -0.945 . . . . 0.0 112.684 -175.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 7.6 ptpt -71.26 -48.66 49.67 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.443 0.697 . . . . 0.0 110.833 174.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 9.7 tt -67.12 -27.71 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.08 -34.48 70.2 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -79.87 -28.3 39.99 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 171.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -149.05 99.23 2.93 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.302 1.041 . . . . 0.0 113.37 -172.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -64.1 -13.98 51.5 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.6 t -77.23 -5.42 49.22 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.984 1.313 . . . . 0.0 114.139 178.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 87.5 mt -71.97 84.4 0.97 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.944 1.298 . . . . 0.0 111.859 177.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -86.36 177.56 7.42 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.463 1.505 . . . . 0.0 112.738 172.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 85.7 -20.86 16.76 Favored Glycine 0 N--CA 1.473 1.132 0 C-N-CA 125.538 1.542 . . . . 0.0 114.9 177.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -61.41 -24.78 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.884 1.274 . . . . 0.0 112.512 177.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -49.47 -35.97 21.28 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.44 1.496 . . . . 0.0 112.975 174.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -57.12 -59.38 5.17 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.595 1.158 . . . . 0.0 111.48 173.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.96 -36.92 85.94 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.582 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.63 -47.25 80.1 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.709 1.204 . . . . 0.0 110.931 174.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.74 -52.41 62.6 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 117.529 -1.224 . . . . 0.0 112.473 168.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 8.9 mm -52.68 -45.23 48.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 CA-C-N 119.705 1.139 . . . . 0.0 111.678 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -67.37 -45.09 77.31 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.043 0.937 . . . . 0.0 112.018 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.84 -47.37 86.65 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.57 1.148 . . . . 0.0 112.132 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -69.05 -38.62 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.879 -0.513 . . . . 0.0 111.986 173.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -63.83 -28.93 70.19 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.181 1.355 . . . . 0.0 112.859 175.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.1 -11.38 48.47 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 120.083 -1.635 . . . . 0.0 114.224 170.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.92 -7.4 52.19 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 173.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 20.6 mt -48.36 149.94 2.52 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.404 1.482 . . . . 0.0 113.137 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -67.04 165.64 25.66 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.062 2.508 . . . . 0.0 113.251 -173.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 68.5 mm-40 -55.43 -27.84 50.5 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.072 0.949 . . . . 0.0 112.722 176.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.24 -51.69 68.7 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.584 1.154 . . . . 0.0 112.707 176.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -70.96 -46.37 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 O-C-N 121.609 -0.682 . . . . 0.0 109.642 175.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -58.48 -40.96 84.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 118.936 -1.106 . . . . 0.0 110.023 -173.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -65.54 -46.59 78.98 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.109 1.363 . . . . 0.0 112.712 173.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -37.24 79.01 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 119.591 1.087 . . . . 0.0 112.796 179.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.2 pp -89.01 -21.53 23.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.491 0.716 . . . . 0.0 112.825 -179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -58.63 -23.72 59.56 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.814 1.646 . . . . 0.0 113.839 176.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.4 -26.96 44.74 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.945 1.298 . . . . 0.0 112.23 168.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 50.55 -134.69 29.55 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.555 1.074 . . . . 0.0 111.845 -175.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.2 pp -143.22 49.21 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 126.166 1.786 . . . . 0.0 111.8 -174.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 56.81 76.86 0.18 Allowed Glycine 0 CA--C 1.54 1.656 0 C-N-CA 126.63 2.062 . . . . 0.0 112.617 -178.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -73.46 170.89 18.86 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.492 2.795 . . . . 0.0 112.96 -174.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -135.08 74.18 1.51 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.892 1.677 . . . . 0.0 110.927 -177.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 22.9 t -142.65 133.15 12.46 Favored Pre-proline 0 N--CA 1.481 1.082 0 C-N-CA 126.164 1.785 . . . . 0.0 109.581 177.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -72.4 -179.91 4.48 Favored 'Trans proline' 0 CA--C 1.547 1.137 0 C-N-CA 123.821 3.014 . . . . 0.0 113.097 174.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 47.9 tp60 . . . . . 0 C--O 1.252 1.215 0 C-N-CA 125.037 1.335 . . . . 0.0 113.069 177.555 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.545 0.763 0 CA-C-O 120.926 0.394 . . . . 0.0 112.042 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -158.69 55.47 0.43 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.61 1.564 . . . . 0.0 112.609 -176.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.21 162.92 40.43 Favored Pre-proline 0 N--CA 1.478 0.945 0 C-N-CA 124.641 1.176 . . . . 0.0 112.131 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -70.15 118.15 5.52 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 123.161 2.574 . . . . 0.0 110.461 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -75.92 114.78 4.0 Favored 'Trans proline' 0 CA--C 1.547 1.133 0 C-N-CA 122.975 2.45 . . . . 0.0 112.878 -177.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -68.53 -21.85 39.33 Favored 'Trans proline' 0 CA--C 1.554 1.499 0 N-CA-C 116.977 1.876 . . . . 0.0 116.977 170.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.89 166.98 27.22 Favored 'Trans proline' 0 C--N 1.362 1.269 0 CA-C-N 124.264 2.559 . . . . 0.0 112.882 176.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.16 148.08 84.63 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.073 2.516 . . . . 0.0 112.543 175.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -61.18 -24.66 66.47 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.492 ' H ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -112.57 32.87 5.31 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.869 2.468 . . . . 0.0 111.629 177.621 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.18 116.55 0.84 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.86 1.264 . . . . 0.0 113.148 171.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.99 -11.53 2.85 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 126.362 1.934 . . . . 0.0 113.629 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.97 158.89 52.57 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.809 1.644 . . . . 0.0 112.453 -178.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.65 174.18 12.67 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.821 2.348 . . . . 0.0 113.609 -178.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -52.09 -35.72 48.68 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.49 1.516 . . . . 0.0 113.094 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -52.9 -41.26 64.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.459 1.503 . . . . 0.0 113.178 172.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 69.7 t -80.75 -41.24 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.488 1.115 . . . . 0.0 111.828 175.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 43.2 t -56.58 -37.82 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.382 0.673 . . . . 0.0 111.299 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.2 tptt -62.12 -50.69 70.88 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.352 -0.842 . . . . 0.0 112.312 172.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.27 -46.8 76.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.523 0.729 . . . . 0.0 111.532 177.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -51.78 -53.8 35.78 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.678 1.191 . . . . 0.0 111.747 168.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.25 -47.45 83.52 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.671 1.123 . . . . 0.0 113.925 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.74 -41.33 96.01 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.155 0.582 . . . . 0.0 111.621 178.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.9 tp -60.16 -44.99 94.58 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.21 0.604 . . . . 0.0 111.42 172.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.636 HD11 HG21 ' A' ' 36' ' ' ILE . 1.5 mm? -61.7 -38.82 89.25 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.513 1.925 . . . . 0.0 114.012 178.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.9 mttm -54.25 -31.1 52.63 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 174.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt -68.65 -44.96 73.03 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.193 0.997 . . . . 0.0 112.399 175.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -101.41 26.99 6.62 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.741 2.016 . . . . 0.0 112.606 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -24.95 43.79 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.903 1.281 . . . . 0.0 113.918 -179.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.81 -30.53 64.14 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 126.297 1.839 . . . . 0.0 113.262 176.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.5 mmtt -65.85 142.86 57.78 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.335 1.054 . . . . 0.0 110.212 176.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.59 158.25 34.38 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.464 0.706 . . . . 0.0 109.465 171.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -37.96 -58.99 1.27 Allowed Pre-proline 0 CA--C 1.552 1.056 0 CA-C-O 117.242 -1.361 . . . . 0.0 113.956 173.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -57.98 -44.25 41.49 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.012 3.141 . . . . 0.0 114.536 177.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -58.97 -39.01 80.42 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.922 0.889 . . . . 0.0 111.755 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.636 HG21 HD11 ' A' ' 25' ' ' LEU . 25.0 mt -66.07 -47.4 85.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 124.026 0.931 . . . . 0.0 110.362 173.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -52.26 -39.01 59.83 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.15 -57.35 9.88 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 122.091 0.948 . . . . 0.0 113.164 170.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -32.49 74.0 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.284 -0.885 . . . . 0.0 112.551 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.725 HD13 ' HE1' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -62.31 -49.97 73.51 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.015 1.326 . . . . 0.0 110.77 170.942 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -54.66 -35.53 63.62 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.893 0.877 . . . . 0.0 113.131 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.36 45.04 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.725 ' HE1' HD13 ' A' ' 40' ' ' LEU . 9.7 p-90 -73.79 -33.83 64.39 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 174.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.422 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -57.74 -31.57 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.401 1.48 . . . . 0.0 111.656 174.663 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -57.8 -17.84 18.32 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.383 0.992 . . . . 0.0 112.82 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.68 -11.32 23.64 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.172 1.389 . . . . 0.0 113.223 176.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.567 HD11 ' CH2' ' A' ' 43' ' ' TRP . 30.5 mt -66.25 -71.21 0.2 Allowed 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 119.079 0.854 . . . . 0.0 112.618 171.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 79.3 99.05 0.26 Allowed Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.431 1.015 . . . . 0.0 112.699 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.16 -171.7 40.97 Favored Glycine 0 CA--C 1.533 1.208 0 C-N-CA 124.39 0.995 . . . . 0.0 113.03 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 57.2 m-20 -58.63 -18.29 29.26 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.369 1.468 . . . . 0.0 113.57 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -52.01 -24.33 6.47 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.748 2.019 . . . . 0.0 113.78 170.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.456 ' HA ' ' CD2' ' A' ' 55' ' ' PHE . 9.1 ptmt -44.84 -41.2 6.84 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.475 1.51 . . . . 0.0 113.712 172.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.34 -43.19 82.15 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.359 1.064 . . . . 0.0 112.953 177.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.55 -45.04 77.32 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.014 -1.054 . . . . 0.0 110.484 169.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.456 ' CD2' ' HA ' ' A' ' 52' ' ' LYS . 3.6 m-30 -60.87 -43.92 97.77 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 119.46 1.027 . . . . 0.0 112.49 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -60.33 -44.2 95.72 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 118.416 0.553 . . . . 0.0 111.762 177.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.93 -38.19 66.91 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.083 0.553 . . . . 0.0 112.486 -178.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -65.78 -48.63 71.15 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.351 1.061 . . . . 0.0 112.7 176.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -43.57 75.27 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.003 0.365 . . . . 0.0 111.255 177.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? -58.28 -54.03 51.57 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.08 1.752 . . . . 0.0 112.967 172.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -53.28 -47.51 69.1 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.222 0.919 . . . . 0.0 112.064 175.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -59.78 -53.41 58.25 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 123.742 0.817 . . . . 0.0 112.451 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 20.5 mttm -57.36 -34.47 68.84 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.216 1.006 . . . . 0.0 112.195 175.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.01 -51.38 32.77 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.882 0.873 . . . . 0.0 111.747 178.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.34 -52.45 65.3 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.321 1.048 . . . . 0.0 110.388 176.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -61.31 -49.84 75.4 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.202 1.001 . . . . 0.0 111.951 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.61 -48.72 78.65 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.511 1.505 . . . . 0.0 112.753 177.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -62.44 -53.96 47.23 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.184 0.594 . . . . 0.0 111.988 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.5 tp -54.09 -51.27 64.68 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.08 1.352 . . . . 0.0 110.354 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.81 -48.19 82.14 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 124.119 0.968 . . . . 0.0 111.393 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.96 -50.59 68.52 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 120.747 1.612 . . . . 0.0 112.315 176.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.0 -50.89 71.97 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.628 0.771 . . . . 0.0 112.666 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.9 t-80 -58.76 -48.96 79.41 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.746 1.219 . . . . 0.0 110.932 178.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -54.38 -44.31 72.17 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.606 1.962 . . . . 0.0 112.539 174.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -59.02 -50.54 73.71 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.472 0.709 . . . . 0.0 112.014 175.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.19 -38.16 90.07 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 121.221 0.534 . . . . 0.0 112.286 175.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.8 t -69.02 -27.56 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 C-N-CA 125.84 1.656 . . . . 0.0 112.868 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.18 -22.04 6.0 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 174.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.2 pttt -116.45 1.52 12.99 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.96 1.704 . . . . 0.0 114.566 174.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 31.9 tpp -86.56 -83.86 0.18 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.754 1.621 . . . . 0.0 111.175 -177.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.7 150.72 76.57 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 127.579 2.351 . . . . 0.0 112.452 -175.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -71.22 -49.7 0.36 Allowed 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 123.899 3.066 . . . . 0.0 113.372 -176.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.4 -37.97 89.4 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.857 1.263 . . . . 0.0 112.2 177.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.69 -36.06 82.61 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.316 0.646 . . . . 0.0 110.774 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.73 -48.32 66.77 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.087 0.955 . . . . 0.0 111.603 173.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 mttm -63.92 -53.3 52.54 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.238 1.015 . . . . 0.0 111.199 177.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -53.46 -55.49 24.83 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.281 0.632 . . . . 0.0 112.275 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -67.79 -37.67 82.34 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.718 0.807 . . . . 0.0 112.67 -176.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -60.5 -49.41 77.66 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.398 -0.814 . . . . 0.0 111.076 172.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.21 -41.02 87.61 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.464 1.106 . . . . 0.0 112.526 175.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.414 ' HA ' HG22 ' A' ' 94' ' ' ILE . 7.5 mp -66.88 -38.93 87.22 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 119.352 0.978 . . . . 0.0 112.608 172.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.5 t -71.4 -42.63 68.1 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 120.473 -1.392 . . . . 0.0 113.022 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -49.56 68.42 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.324 0.65 . . . . 0.0 109.614 174.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.414 HG22 ' HA ' ' A' ' 91' ' ' LEU . 8.8 tp -65.46 -28.14 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -178.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.61 -26.87 68.26 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 177.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -104.66 -27.34 11.88 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.379 1.071 . . . . 0.0 113.173 173.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -89.69 82.78 6.26 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.503 1.521 . . . . 0.0 113.134 -178.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -73.38 -24.45 60.31 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 120.351 -1.468 . . . . 0.0 113.967 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.1 t -75.97 -17.87 59.54 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.36 1.064 . . . . 0.0 113.793 -178.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -79.87 164.3 23.68 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.836 1.654 . . . . 0.0 112.166 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 24.5 p30 -71.94 170.8 13.0 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.2 1.0 . . . . 0.0 113.063 174.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -77.83 53.43 3.69 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 125.417 1.484 . . . . 0.0 114.078 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.94 -28.78 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.933 1.293 . . . . 0.0 112.885 -177.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -43.71 -35.8 1.97 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.502 1.521 . . . . 0.0 114.032 170.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -60.95 -59.38 5.46 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.599 0.76 . . . . 0.0 111.536 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.11 -31.54 72.79 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.831 0.741 . . . . 0.0 111.892 -176.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.36 -52.33 65.71 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.451 0.301 . . . . 0.0 111.445 172.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -54.67 -46.87 74.1 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 117.91 -1.043 . . . . 0.0 111.646 174.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 27.4 mm -52.97 -49.81 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.355 1.062 . . . . 0.0 111.731 174.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 68.6 mm-40 -64.41 -46.22 84.21 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.064 1.302 . . . . 0.0 112.947 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -57.39 -48.9 77.84 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.124 0.969 . . . . 0.0 111.725 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.59 -40.09 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.161 173.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -58.79 -37.87 77.29 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.304 1.411 . . . . 0.0 113.439 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 50.8 mttm -63.34 -17.41 62.55 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 173.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 4.8 t -119.93 24.42 10.53 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.356 1.862 . . . . 0.0 113.199 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.69 71.29 2.45 Favored Pre-proline 0 CA--C 1.552 1.033 0 C-N-CA 126.253 1.821 . . . . 0.0 110.643 177.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.6 166.93 24.2 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.013 2.475 . . . . 0.0 112.188 174.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -60.89 -24.66 66.15 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 174.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 71.5 m -62.7 -51.61 66.54 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 120.009 1.277 . . . . 0.0 112.044 176.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.6 p -70.22 -38.94 76.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 121.905 -0.497 . . . . 0.0 111.137 176.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 7.2 tttt -61.21 -45.69 93.52 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.109 0.868 . . . . 0.0 112.071 177.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -69.87 -39.43 76.32 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.057 0.943 . . . . 0.0 113.05 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -67.54 -36.74 81.56 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.199 -0.938 . . . . 0.0 112.412 176.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.23 -19.44 31.64 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.351 1.06 . . . . 0.0 113.26 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -54.59 -26.87 35.18 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.951 1.7 . . . . 0.0 113.833 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.94 -21.06 66.31 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.978 1.711 . . . . 0.0 113.233 172.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 60.76 -134.99 49.48 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.606 1.574 . . . . 0.0 112.822 -177.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -128.92 62.29 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 126.49 1.916 . . . . 0.0 110.777 -171.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 50.85 74.81 0.25 Allowed Glycine 0 CA--C 1.541 1.686 0 C-N-CA 126.462 1.982 . . . . 0.0 113.138 -173.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -71.79 95.94 0.74 Allowed 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 124.38 3.387 . . . . 0.0 111.96 -171.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 57.28 107.47 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 127.116 2.166 . . . . 0.0 113.263 -168.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 7.4 p -107.22 79.3 0.71 Allowed Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.518 1.527 . . . . 0.0 111.689 174.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -72.78 -12.09 26.26 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.321 2.681 . . . . 0.0 114.357 179.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . 0.298 13.8 pt20 . . . . . 0 C--O 1.253 1.268 1 C-N-CA 132.297 4.239 . . . . 0.0 118.194 -179.527 . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.548 0.892 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.8 -63.19 1.11 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.664 1.186 . . . . 0.0 112.372 178.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.3 158.46 86.72 Favored Pre-proline 0 N--CA 1.471 0.609 0 C-N-CA 124.407 1.083 . . . . 0.0 111.632 174.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -69.81 165.16 31.94 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.589 2.193 . . . . 0.0 111.799 177.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.59 116.46 3.66 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.647 2.898 . . . . 0.0 111.399 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -68.67 -23.06 36.76 Favored 'Trans proline' 0 CA--C 1.551 1.335 0 CA-C-O 115.882 -1.799 . . . . 0.0 115.511 167.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.02 160.47 49.22 Favored 'Trans proline' 0 C--N 1.363 1.314 0 CA-C-N 124.122 2.508 . . . . 0.0 112.537 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -64.87 130.14 25.24 Favored 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 123.54 2.827 . . . . 0.0 111.454 174.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -52.1 -49.78 62.92 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.125 -0.984 . . . . 0.0 112.505 174.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.16 -2.07 17.33 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -15.48 99.12 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.782 2.833 . . . . 0.0 115.192 -175.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 162.61 -21.69 0.19 Allowed Glycine 0 CA--C 1.537 1.413 0 C-N-CA 124.549 1.071 . . . . 0.0 114.98 -177.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.17 161.56 72.63 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 124.54 1.136 . . . . 0.0 113.135 176.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.47 172.67 15.67 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.438 2.758 . . . . 0.0 113.991 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -52.84 -36.34 58.66 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.991 1.316 . . . . 0.0 113.33 -179.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -54.05 -39.91 66.64 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.513 1.525 . . . . 0.0 112.7 174.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 72.3 t -83.29 -39.87 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.536 1.534 . . . . 0.0 111.754 176.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 59.4 t -55.9 -39.72 58.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.066 0.946 . . . . 0.0 111.022 177.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 tptm -60.57 -50.64 72.74 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.718 0.807 . . . . 0.0 111.935 172.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.78 -47.15 74.32 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.672 0.669 . . . . 0.0 111.945 178.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.52 ' CD1' HD11 ' A' ' 40' ' ' LEU . 10.3 t80 -53.48 -53.47 51.03 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.459 1.104 . . . . 0.0 112.06 168.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.21 -47.42 83.51 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 119.086 0.857 . . . . 0.0 113.136 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -65.15 -37.65 88.07 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.793 0.837 . . . . 0.0 112.054 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.9 tp -60.57 -52.55 64.67 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.559 0.744 . . . . 0.0 111.193 171.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.562 HD21 HD21 ' A' ' 40' ' ' LEU . 3.8 mm? -71.28 -27.34 63.36 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.019 1.328 . . . . 0.0 113.601 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.5 mmtt -52.48 -48.07 66.15 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.029 1.731 . . . . 0.0 112.687 173.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 tttt -67.08 -24.03 65.92 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 178.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -109.75 30.48 6.64 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.32 2.248 . . . . 0.0 112.46 178.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -54.83 -23.3 17.68 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 119.976 -1.703 . . . . 0.0 113.917 -173.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.7 p -77.08 8.17 4.19 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 128.715 2.806 . . . . 0.0 114.989 172.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.09 171.95 0.23 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.25 1.82 . . . . 0.0 114.112 170.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 m -138.17 170.07 16.68 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 127.773 2.429 . . . . 0.0 109.409 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -40.14 -56.76 3.17 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 127.335 2.254 . . . . 0.0 113.436 175.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.64 -36.51 14.36 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 122.51 2.14 . . . . 0.0 113.856 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.93 -40.91 95.76 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.556 1.071 . . . . 0.0 111.064 178.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 22.6 mt -62.57 -53.39 47.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.44 -38.45 91.17 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 119.017 -1.073 . . . . 0.0 111.909 -175.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.7 ttmt -65.19 -60.17 3.29 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 125.103 1.361 . . . . 0.0 112.138 177.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -59.41 -38.62 81.07 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.678 0.672 . . . . 0.0 112.197 -179.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.58 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.0 OUTLIER -66.22 -51.15 60.46 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-O 119.323 -0.37 . . . . 0.0 110.474 176.4 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -59.01 -33.3 70.56 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.99 -52.17 65.14 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.686 ' CH2' HD11 ' A' ' 47' ' ' LEU . 8.7 p-90 -73.91 -35.02 64.59 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 114.376 1.251 . . . . 0.0 114.376 169.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -57.6 -27.8 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 O-C-N 120.266 -1.521 . . . . 0.0 111.795 176.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -56.17 -25.75 47.86 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.775 0.83 . . . . 0.0 112.501 176.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 38.7 p -88.65 -20.97 24.22 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.686 HD11 ' CH2' ' A' ' 43' ' ' TRP . 41.3 mt -64.77 -62.13 1.76 Allowed 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 118.433 0.56 . . . . 0.0 111.909 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 75.85 93.79 0.18 Allowed Glycine 0 CA--C 1.532 1.124 0 C-N-CA 124.728 1.156 . . . . 0.0 112.544 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.71 -165.33 29.58 Favored Glycine 0 CA--C 1.53 0.99 0 C-N-CA 124.792 1.187 . . . . 0.0 112.307 -177.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.7 -13.28 5.55 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.11 1.364 . . . . 0.0 113.907 177.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -52.94 -24.68 9.81 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.527 1.931 . . . . 0.0 113.635 174.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt -53.01 -36.11 60.14 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.389 1.476 . . . . 0.0 114.203 170.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.7 -43.26 80.52 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.099 0.96 . . . . 0.0 111.475 176.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.53 -41.53 90.25 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.688 -0.632 . . . . 0.0 111.419 170.075 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -58.99 -50.28 74.68 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 119.797 1.18 . . . . 0.0 112.365 175.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.65 -45.31 92.38 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 118.106 0.412 . . . . 0.0 111.814 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.3 t -66.97 -43.18 83.71 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -65.51 -54.01 34.23 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.437 0.695 . . . . 0.0 112.114 177.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -49.76 -46.43 50.54 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.907 0.883 . . . . 0.0 111.584 177.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -57.49 -55.71 31.27 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.173 1.389 . . . . 0.0 113.269 172.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -55.01 -44.03 74.19 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 118.89 0.768 . . . . 0.0 112.726 176.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.72 -53.31 56.32 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.525 1.13 . . . . 0.0 112.917 176.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 6.2 mtpp -56.66 -36.17 69.25 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 119.053 -0.499 . . . . 0.0 111.847 174.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.14 -49.9 52.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.814 0.846 . . . . 0.0 111.673 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.9 tttt -58.95 -51.16 71.24 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.412 1.085 . . . . 0.0 110.827 177.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.94 -50.1 74.78 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.682 1.193 . . . . 0.0 112.134 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.52 -49.97 71.18 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 119.179 0.9 . . . . 0.0 113.118 176.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -63.96 -47.11 81.71 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.465 0.706 . . . . 0.0 112.505 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.6 mt -56.46 -46.79 80.19 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.897 0.879 . . . . 0.0 112.032 173.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.25 -48.43 81.49 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.273 1.029 . . . . 0.0 111.182 177.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -50.87 67.41 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 119.963 1.256 . . . . 0.0 112.039 176.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.61 -48.92 75.38 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.376 0.67 . . . . 0.0 112.345 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.9 m80 -55.51 -54.09 48.29 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.961 0.904 . . . . 0.0 111.515 173.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -54.52 -41.04 69.21 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.897 1.679 . . . . 0.0 112.673 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -51.3 69.34 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.822 0.849 . . . . 0.0 111.935 174.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.07 -29.29 69.03 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 175.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 63.8 t -73.02 -28.44 26.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 126.65 1.98 . . . . 0.0 112.286 175.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.86 -36.36 58.9 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 174.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -90.98 2.17 56.49 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.642 1.577 . . . . 0.0 113.987 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 3.9 ttm -97.43 -77.02 0.5 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.421 1.488 . . . . 0.0 111.519 -174.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.71 149.56 73.33 Favored Pre-proline 0 N--CA 1.481 1.122 0 C-N-CA 126.285 1.834 . . . . 0.0 112.806 -176.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.24 -46.53 0.66 Allowed 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.768 2.978 . . . . 0.0 113.184 -177.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -68.02 -33.06 73.87 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.565 1.146 . . . . 0.0 112.523 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -66.42 -33.59 76.04 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.915 0.486 . . . . 0.0 111.228 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.11 -51.77 65.36 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.857 0.753 . . . . 0.0 110.594 169.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -57.27 -54.7 43.82 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.513 1.125 . . . . 0.0 110.849 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.48 -52.53 65.2 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.22 -34.86 78.98 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.352 0.661 . . . . 0.0 112.432 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.3 -48.12 76.85 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 119.716 1.143 . . . . 0.0 110.774 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.25 -45.68 76.08 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.051 0.941 . . . . 0.0 112.34 171.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 8.3 tp -63.1 -39.14 93.82 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 118.836 0.744 . . . . 0.0 112.67 174.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.0 t -71.92 -41.72 67.54 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 120.603 -1.31 . . . . 0.0 112.238 -177.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -68.61 -42.49 78.06 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.283 0.633 . . . . 0.0 110.869 176.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.9 tp -70.07 -31.46 47.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 118.46 0.573 . . . . 0.0 112.311 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.09 -31.7 72.17 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -81.59 -12.83 58.61 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 172.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.61 ' HB3' HD13 ' A' ' 100' ' ' LEU . 1.7 m-20 -158.15 95.71 1.39 Allowed 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 119.882 1.219 . . . . 0.0 113.533 -171.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.72 -8.63 57.65 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 58.8 m -80.99 -0.06 37.83 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.638 1.575 . . . . 0.0 114.666 178.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.61 HD13 ' HB3' ' A' ' 97' ' ' ASP . 6.3 mp -69.89 172.44 7.73 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.33 1.452 . . . . 0.0 112.694 175.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -69.34 177.68 2.72 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.197 1.399 . . . . 0.0 111.78 173.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.88 55.62 3.05 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.642 1.591 . . . . 0.0 113.881 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.74 -27.46 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 124.654 1.182 . . . . 0.0 112.788 -177.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -47.96 -34.19 8.84 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.508 1.523 . . . . 0.0 113.536 172.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -59.2 5.77 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 118.775 0.716 . . . . 0.0 111.304 173.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.89 79.23 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.538 0.735 . . . . 0.0 112.488 -179.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -53.91 -52.23 61.2 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.421 1.088 . . . . 0.0 110.714 169.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -49.61 75.54 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 117.631 -1.176 . . . . 0.0 111.509 175.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.5 mm -54.21 -49.58 61.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 119.53 1.059 . . . . 0.0 111.501 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 69.5 mm-40 -62.06 -44.74 96.03 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.301 -0.874 . . . . 0.0 112.369 176.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.61 -48.95 78.58 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 119.131 0.878 . . . . 0.0 112.329 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -67.15 -35.76 75.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.514 0.725 . . . . 0.0 111.85 176.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -69.78 -32.61 71.19 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.881 0.872 . . . . 0.0 112.947 175.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.7 mmtm -68.43 -24.17 64.71 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 119.75 -1.844 . . . . 0.0 112.079 175.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.4 t -98.93 44.22 1.03 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.296 1.439 . . . . 0.0 112.78 173.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.41 HD22 HG11 ' A' ' 120' ' ' VAL . 2.4 mt -50.33 145.1 10.74 Favored Pre-proline 0 N--CA 1.478 0.94 0 O-C-N 120.625 -1.297 . . . . 0.0 112.005 172.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -64.81 160.02 42.83 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 122.945 2.43 . . . . 0.0 112.645 -176.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -61.45 -27.6 68.68 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.538 -0.726 . . . . 0.0 112.174 177.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 22.7 t -61.14 -51.69 68.01 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.641 1.109 . . . . 0.0 112.129 177.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.41 HG11 HD22 ' A' ' 116' ' ' LEU . 11.2 p -74.99 -38.76 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 O-C-N 121.612 -0.68 . . . . 0.0 111.804 178.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -56.98 -51.15 70.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 118.215 -0.898 . . . . 0.0 111.626 171.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -63.95 -43.52 95.57 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.015 1.28 . . . . 0.0 112.699 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -66.51 -34.43 77.89 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.256 0.935 . . . . 0.0 112.804 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.34 -23.88 24.46 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.207 1.003 . . . . 0.0 113.242 178.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -55.76 -24.71 37.01 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 126.472 1.909 . . . . 0.0 113.187 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 8.5 tmtm? -52.71 -39.58 62.17 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 125.145 1.378 . . . . 0.0 111.735 172.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 41.64 -131.85 3.89 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.828 1.68 . . . . 0.0 111.848 -178.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.1 pp -151.16 54.93 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 126.087 1.755 . . . . 0.0 111.397 -176.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 51.17 74.77 0.26 Allowed Glycine 0 CA--C 1.541 1.688 0 C-N-CA 125.998 1.761 . . . . 0.0 113.587 -176.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -70.43 -27.21 23.57 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.41 2.74 . . . . 0.0 114.359 -170.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 41.32 58.27 2.68 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 127.31 2.244 . . . . 0.0 114.314 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 14.6 p -70.91 133.97 85.93 Favored Pre-proline 0 N--CA 1.473 0.721 0 C-N-CA 124.904 1.282 . . . . 0.0 111.156 179.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -73.06 -169.26 0.49 Allowed 'Trans proline' 0 CA--C 1.549 1.232 0 C-N-CA 123.656 2.904 . . . . 0.0 112.597 174.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.239 0 C-N-CA 126.145 1.778 . . . . 0.0 112.664 -177.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 16.2 t70 . . . . . 0 CA--C 1.548 0.885 0 CA-C-O 120.846 0.355 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -157.65 -174.91 5.09 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.382 1.073 . . . . 0.0 112.642 175.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 p -56.52 158.44 8.14 Favored Pre-proline 0 N--CA 1.483 1.195 0 C-N-CA 124.319 1.048 . . . . 0.0 113.115 171.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -67.96 162.71 38.67 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 122.558 2.172 . . . . 0.0 112.277 178.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -63.46 117.63 4.58 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.445 2.763 . . . . 0.0 111.437 -179.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -71.6 -21.3 25.82 Favored 'Trans proline' 0 CA--C 1.553 1.433 0 CA-C-O 115.714 -1.869 . . . . 0.0 116.287 167.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.83 165.98 29.22 Favored 'Trans proline' 0 C--N 1.362 1.275 0 CA-C-N 124.36 2.593 . . . . 0.0 112.356 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.432 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 35.2 Cg_endo -58.77 131.5 42.45 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.52 2.146 . . . . 0.0 111.019 169.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -49.89 -49.6 49.01 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.999 0.52 . . . . 0.0 110.734 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.546 HD23 ' H ' ' A' ' 10' ' ' LEU . 2.2 pt? -80.24 28.54 0.3 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.671 1.988 . . . . 0.0 115.081 176.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -40.32 107.62 0.07 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.494 1.518 . . . . 0.0 114.297 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.55 17.11 0.3 Allowed Glycine 0 CA--C 1.537 1.466 0 C-N-CA 124.784 1.183 . . . . 0.0 115.044 -174.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.67 158.23 36.15 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.842 1.657 . . . . 0.0 112.132 -173.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -73.0 167.18 28.05 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.778 2.319 . . . . 0.0 112.732 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -53.78 -38.74 64.78 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.61 1.164 . . . . 0.0 113.093 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.96 -40.14 63.48 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.586 1.554 . . . . 0.0 112.825 173.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.9 t -82.75 -39.71 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.029 1.332 . . . . 0.0 111.713 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 41.8 t -56.03 -40.25 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.863 0.756 . . . . 0.0 110.955 176.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.4 tptt -61.26 -50.52 72.7 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.081 -1.012 . . . . 0.0 111.866 174.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.0 75.01 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.43 0.692 . . . . 0.0 112.025 178.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.432 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 1.5 t80 -52.82 -53.75 44.11 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.728 1.211 . . . . 0.0 112.273 168.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.66 -47.37 85.9 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.646 1.112 . . . . 0.0 113.579 -178.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -61.15 -38.77 87.62 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.849 0.86 . . . . 0.0 111.407 176.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.5 tp -64.15 -47.69 78.92 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 121.819 -0.55 . . . . 0.0 111.465 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.61 -35.52 76.32 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.576 1.55 . . . . 0.0 114.26 -178.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.22 -31.0 61.12 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.348 1.431 . . . . 0.0 113.025 175.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -70.38 -36.43 74.11 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.721 1.608 . . . . 0.0 112.507 176.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -109.81 20.18 18.31 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.438 1.895 . . . . 0.0 112.375 -176.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -26.1 66.6 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.053 -1.654 . . . . 0.0 113.5 -175.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 33.0 p -85.27 -0.32 54.33 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.659 2.384 . . . . 0.0 114.379 177.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -82.69 167.91 17.76 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 125.418 1.487 . . . . 0.0 112.609 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.21 171.52 9.44 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.926 2.09 . . . . 0.0 111.94 178.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -46.04 -61.16 2.73 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 126.746 2.018 . . . . 0.0 112.595 172.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.35 -38.32 20.75 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 121.894 1.729 . . . . 0.0 112.744 177.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -42.07 99.35 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 120.444 -1.41 . . . . 0.0 112.684 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 73.1 mt -68.18 -53.34 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 124.25 1.02 . . . . 0.0 110.385 173.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -56.9 -37.62 71.67 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.368 0.986 . . . . 0.0 112.468 -174.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -59.47 -56.99 15.07 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.146 1.378 . . . . 0.0 111.919 177.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -65.59 -35.2 80.15 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.688 0.395 . . . . 0.0 111.919 -178.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.775 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.8 mm? -61.32 -51.07 70.4 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.053 1.341 . . . . 0.0 112.229 170.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -60.71 -36.94 80.07 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.25 -0.906 . . . . 0.0 112.862 177.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.34 -49.16 72.95 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.775 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.2 p-90 -73.7 -35.59 65.15 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 170.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -56.63 -31.59 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 125.393 1.477 . . . . 0.0 112.229 175.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -57.6 -19.61 27.16 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 119.027 0.831 . . . . 0.0 112.906 176.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.7 -15.35 23.98 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.119 1.367 . . . . 0.0 113.727 174.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.674 HD11 ' CH2' ' A' ' 43' ' ' TRP . 48.7 mt -67.76 -65.59 0.67 Allowed 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 118.924 0.784 . . . . 0.0 112.453 174.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 76.88 91.27 0.25 Allowed Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.163 0.887 . . . . 0.0 112.621 -178.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -175.39 -164.25 29.63 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.093 1.33 . . . . 0.0 112.348 -176.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -58.05 -15.38 9.07 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.996 1.318 . . . . 0.0 113.738 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -53.07 -25.41 12.66 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.612 2.365 . . . . 0.0 113.984 174.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -52.3 -39.48 60.57 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.968 1.707 . . . . 0.0 113.221 171.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.59 -52.04 59.61 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.229 1.012 . . . . 0.0 110.532 176.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.88 -46.03 71.24 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.579 -0.701 . . . . 0.0 111.367 176.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -54.76 -49.14 71.59 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 173.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.03 -47.97 79.63 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 119.129 0.877 . . . . 0.0 111.531 179.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -48.71 80.59 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.075 1.35 . . . . 0.0 113.298 177.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -61.01 -53.02 62.38 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.519 1.128 . . . . 0.0 111.695 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -54.09 -46.45 72.08 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.888 0.875 . . . . 0.0 111.811 177.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.6 mttt -55.82 -53.03 61.64 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.069 0.948 . . . . 0.0 112.361 172.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -55.78 -42.84 76.11 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.887 0.875 . . . . 0.0 112.639 177.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -61.61 -53.34 57.52 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.897 0.879 . . . . 0.0 112.869 176.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt -60.67 -32.29 71.5 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 118.997 -0.525 . . . . 0.0 111.82 175.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.34 -51.61 35.3 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.796 0.838 . . . . 0.0 111.15 178.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.8 ttmt -61.06 -48.1 83.29 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 118.214 0.461 . . . . 0.0 110.593 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.94 -51.82 68.06 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.578 1.151 . . . . 0.0 112.707 177.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.67 -43.75 90.01 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.782 1.174 . . . . 0.0 112.858 177.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -63.22 -50.45 70.19 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.656 0.782 . . . . 0.0 112.022 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.3 mt -57.1 -50.81 71.63 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 124.113 0.965 . . . . 0.0 111.171 176.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.42 -45.33 84.74 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.991 0.917 . . . . 0.0 112.283 175.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -59.04 -50.78 72.79 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-N 120.766 1.621 . . . . 0.0 111.781 177.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.28 75.81 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -56.63 -52.28 65.46 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.932 0.893 . . . . 0.0 110.699 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.45 -41.61 73.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.973 1.309 . . . . 0.0 113.224 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -57.83 -52.42 65.53 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.931 0.892 . . . . 0.0 112.255 173.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.57 -36.06 82.66 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 176.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 37.3 t -68.59 -27.83 37.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 126.321 1.848 . . . . 0.0 113.166 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.6 -29.29 37.0 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.766 1.395 . . . . 0.0 114.766 175.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.6 pttt -105.89 0.43 25.89 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.187 1.795 . . . . 0.0 113.795 176.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 45.8 ttm -93.44 -80.55 0.38 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.127 1.771 . . . . 0.0 111.799 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.91 143.82 49.15 Favored Pre-proline 0 N--CA 1.48 1.041 0 C-N-CA 126.997 2.119 . . . . 0.0 112.655 -175.024 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -68.21 -49.83 0.88 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 123.666 2.91 . . . . 0.0 113.304 -178.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.43 -37.01 86.04 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.241 1.416 . . . . 0.0 113.04 176.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.4 -40.09 95.13 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 118.761 -0.638 . . . . 0.0 110.062 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 12.5 tppt? -55.76 -50.18 71.13 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.478 171.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 50.4 mmtt -54.96 -54.6 40.74 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.266 0.939 . . . . 0.0 110.727 -179.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.38 -47.57 81.5 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -71.0 -38.93 72.67 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.107 0.963 . . . . 0.0 112.285 -177.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.25 -47.88 82.4 Favored 'General case' 0 N--CA 1.465 0.297 0 O-C-N 121.052 -1.03 . . . . 0.0 111.409 171.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -56.85 -43.7 81.41 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.757 0.708 . . . . 0.0 112.225 172.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 13.0 tp -62.44 -39.94 94.97 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.722 1.147 . . . . 0.0 113.018 172.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.5 t -70.67 -45.16 65.59 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.857 -1.152 . . . . 0.0 112.81 -177.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -41.93 79.71 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.6 0.76 . . . . 0.0 110.984 175.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.3 tt -70.85 -29.73 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 179.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.49 -34.83 71.34 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 176.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -79.42 -28.29 41.75 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.399 1.08 . . . . 0.0 113.479 172.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -130.88 89.49 2.76 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.973 1.709 . . . . 0.0 112.469 -173.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -73.84 -9.14 58.35 Favored 'General case' 0 CA--C 1.549 0.933 0 O-C-N 120.643 -1.286 . . . . 0.0 113.909 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 66.8 m -70.12 -7.04 38.33 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 126.491 1.916 . . . . 0.0 115.233 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -67.83 166.21 15.93 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.783 1.233 . . . . 0.0 112.58 176.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.34 -178.51 3.5 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.217 1.407 . . . . 0.0 112.796 175.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.98 51.51 0.94 Allowed Glycine 0 N--CA 1.475 1.278 0 C-N-CA 126.382 1.944 . . . . 0.0 114.69 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 2.4 tp -53.05 -32.61 18.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 125.515 1.526 . . . . 0.0 113.32 177.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -46.64 -38.1 9.2 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.484 1.113 . . . . 0.0 113.092 173.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -62.52 -59.15 5.35 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.552 0.741 . . . . 0.0 112.039 171.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -64.5 -36.13 83.19 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.976 0.91 . . . . 0.0 112.815 -175.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -53.68 -54.65 34.9 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 126.636 1.974 . . . . 0.0 110.866 166.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 54.0 tttt -52.63 -52.09 57.08 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 117.686 -1.15 . . . . 0.0 110.597 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.9 mm -52.27 -50.96 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 119.44 1.018 . . . . 0.0 111.471 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -64.84 -42.57 94.8 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.1 0.864 . . . . 0.0 112.549 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -64.52 -36.13 83.22 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.887 1.275 . . . . 0.0 113.044 179.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.7 pp -78.13 -42.56 27.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 119.165 0.893 . . . . 0.0 111.856 170.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.41 ' HA ' HD12 ' A' ' 116' ' ' LEU . 58.6 t80 -55.57 -42.34 74.6 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.84 1.256 . . . . 0.0 113.187 179.149 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.63 -21.05 66.62 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 120.683 -1.261 . . . . 0.0 112.988 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 11.1 t -109.44 22.17 16.12 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.966 1.707 . . . . 0.0 113.201 -177.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.41 HD12 ' HA ' ' A' ' 113' ' ' TYR . 31.8 mt -112.45 156.22 42.55 Favored Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 125.589 1.555 . . . . 0.0 112.886 178.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -71.73 160.93 46.71 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.856 3.037 . . . . 0.0 112.899 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -63.39 -20.49 65.59 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 175.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.2 p -65.42 -51.55 59.52 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.933 1.242 . . . . 0.0 112.21 176.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.2 p -72.56 -39.08 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.649 -0.657 . . . . 0.0 111.424 176.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 29.1 mtmt -57.87 -50.15 74.3 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.034 0.834 . . . . 0.0 111.8 173.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -65.88 -40.76 91.9 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.552 1.069 . . . . 0.0 113.551 177.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -67.22 -35.35 79.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.575 1.08 . . . . 0.0 112.873 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.46 -23.33 26.03 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.356 1.063 . . . . 0.0 113.418 178.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -54.65 -20.81 8.9 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 126.609 1.964 . . . . 0.0 113.834 177.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.84 -18.94 58.76 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.32 1.448 . . . . 0.0 113.694 170.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -105.26 110.37 3.46 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 127.737 2.589 . . . . 0.0 111.657 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -117.16 63.4 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 126.289 1.836 . . . . 0.0 111.134 -174.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 52.44 74.86 0.26 Allowed Glycine 0 CA--C 1.538 1.521 0 C-N-CA 125.464 1.507 . . . . 0.0 112.698 -173.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -68.3 130.58 21.5 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.771 2.314 . . . . 0.0 111.428 -176.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 57.29 100.78 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 127.975 2.51 . . . . 0.0 114.512 -175.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 10.0 t -119.2 74.59 14.75 Favored Pre-proline 0 N--CA 1.483 1.203 0 C-N-CA 124.936 1.294 . . . . 0.0 111.222 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -75.81 -5.63 16.62 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 124.335 3.357 . . . . 0.0 114.74 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 128.421 2.688 . . . . 0.0 113.206 179.51 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 24.9 t70 . . . . . 0 CA--C 1.55 0.968 0 CA-C-O 121.752 0.786 . . . . 0.0 112.438 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -114.68 -172.02 2.04 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.273 1.829 . . . . 0.0 112.304 -176.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.7 155.16 4.15 Favored Pre-proline 0 N--CA 1.477 0.881 0 C-N-CA 124.544 1.138 . . . . 0.0 112.772 171.471 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -67.27 165.83 25.45 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 122.945 2.43 . . . . 0.0 111.539 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -64.66 117.79 4.83 Favored 'Trans proline' 0 CA--C 1.547 1.158 0 C-N-CA 122.529 2.153 . . . . 0.0 111.726 176.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.04 -21.43 27.61 Favored 'Trans proline' 0 CA--C 1.555 1.569 0 C-N-CA 122.523 2.149 . . . . 0.0 116.55 166.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.36 170.25 17.73 Favored 'Trans proline' 0 C--N 1.363 1.308 0 CA-C-N 124.18 2.529 . . . . 0.0 112.762 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -62.47 123.64 12.78 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.578 2.186 . . . . 0.0 110.846 173.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -52.87 -38.2 61.32 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 122.163 0.982 . . . . 0.0 111.868 169.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.492 ' HB3' HG21 ' A' ' 44' ' ' VAL . 0.5 OUTLIER -83.82 22.42 1.13 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 128.709 2.804 . . . . 0.0 115.064 175.324 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -41.0 113.22 0.37 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.657 1.583 . . . . 0.0 113.44 175.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.94 23.28 0.19 Allowed Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.207 1.384 . . . . 0.0 114.742 -175.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -125.2 158.85 62.18 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 125.789 1.636 . . . . 0.0 112.347 -172.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.37 170.72 19.69 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.211 2.607 . . . . 0.0 113.106 -179.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -52.45 -38.27 58.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.81 1.244 . . . . 0.0 113.277 -177.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -56.22 -40.2 73.7 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.623 1.569 . . . . 0.0 112.349 176.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 79.7 t -79.46 -39.55 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.963 1.305 . . . . 0.0 111.809 174.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 57.8 t -55.65 -38.94 52.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.0 0.92 . . . . 0.0 111.037 177.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 tppp? -60.43 -50.63 72.81 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.799 -1.188 . . . . 0.0 112.221 174.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.67 -47.62 79.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.361 1.064 . . . . 0.0 111.616 177.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.63 -51.7 46.45 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.167 0.987 . . . . 0.0 111.671 168.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.54 -47.15 86.88 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 120.183 1.356 . . . . 0.0 113.287 -176.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -65.45 -34.18 77.68 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 122.545 0.338 . . . . 0.0 111.692 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.95 -54.63 14.32 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 173.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.6 HD22 HD21 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -57.26 -34.17 68.36 Favored 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 123.871 0.868 . . . . 0.0 112.517 -178.503 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -51.5 -30.54 20.51 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 171.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.8 tttt -74.91 -36.08 62.22 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.778 1.231 . . . . 0.0 113.145 173.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -102.64 15.08 30.32 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.499 1.52 . . . . 0.0 113.052 -177.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -63.36 -19.74 64.91 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.477 -1.39 . . . . 0.0 113.385 -172.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -100.4 1.04 40.99 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 126.947 2.099 . . . . 0.0 113.773 -178.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -79.38 177.73 8.63 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.786 1.635 . . . . 0.0 111.819 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.93 172.1 8.36 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.864 2.066 . . . . 0.0 111.938 177.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -49.56 -59.24 7.05 Favored Pre-proline 0 CA--C 1.546 0.793 0 C-N-CA 124.721 1.208 . . . . 0.0 113.107 175.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.21 -36.93 15.3 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.868 1.712 . . . . 0.0 112.607 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.74 -49.41 77.6 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.896 -1.127 . . . . 0.0 112.182 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 87.0 mt -61.94 -53.42 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-O 117.928 -1.034 . . . . 0.0 109.289 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -51.83 -44.87 63.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.301 1.41 . . . . 0.0 111.677 -176.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -51.13 68.34 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 125.108 1.363 . . . . 0.0 112.994 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.62 -39.14 92.87 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.106 0.562 . . . . 0.0 112.479 176.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.72 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.4 mm? -61.68 -50.18 73.52 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.518 1.127 . . . . 0.0 109.848 173.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.567 ' HA ' HG12 ' A' ' 44' ' ' VAL . 3.8 m-20 -62.74 -28.38 69.93 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 178.24 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.34 -54.8 39.09 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.465 -0.772 . . . . 0.0 112.667 174.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.72 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.3 p-90 -73.84 -30.42 62.66 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 175.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.804 HG23 HD12 ' A' ' 47' ' ' LEU . 0.3 OUTLIER -67.35 -29.67 46.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 120.623 -1.298 . . . . 0.0 112.667 175.567 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -58.95 -15.55 13.48 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.012 0.824 . . . . 0.0 113.147 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.9 p -115.07 -2.99 12.64 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.363 1.465 . . . . 0.0 113.56 177.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.804 HD12 HG23 ' A' ' 44' ' ' VAL . 9.7 mt -62.05 -53.44 55.45 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 175.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -166.59 -146.81 4.99 Favored Glycine 0 C--N 1.336 0.56 0 C-N-CA 123.957 0.789 . . . . 0.0 112.41 -166.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -98.03 -65.68 0.88 Allowed Glycine 0 C--O 1.223 -0.588 0 C-N-CA 124.683 1.135 . . . . 0.0 112.992 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -59.43 -31.68 69.5 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.622 1.169 . . . . 0.0 112.848 -168.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.624 ' HB3' HG22 ' A' ' 44' ' ' VAL . 65.1 m-85 -55.39 -23.44 24.65 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 126.666 1.986 . . . . 0.0 113.649 174.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.2 ptmt -52.95 -33.89 53.08 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 171.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.79 -35.73 79.17 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.479 1.112 . . . . 0.0 111.574 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -43.33 92.22 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 117.961 -1.018 . . . . 0.0 110.831 168.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -64.33 -48.3 76.12 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 120.041 1.291 . . . . 0.0 112.512 177.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -58.64 -40.73 84.23 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.671 -0.643 . . . . 0.0 111.545 179.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.21 -34.54 59.25 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.99 -51.0 67.59 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.674 1.19 . . . . 0.0 110.737 170.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.5 ttpp -54.38 -45.27 72.8 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 117.987 0.358 . . . . 0.0 111.042 -175.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -61.7 -55.92 25.18 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.988 1.715 . . . . 0.0 113.016 172.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -57.22 -48.61 78.35 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.445 1.021 . . . . 0.0 112.575 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.0 ttt -64.01 -51.28 64.95 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.631 0.772 . . . . 0.0 112.424 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -52.93 -40.04 63.31 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 122.972 0.509 . . . . 0.0 111.86 172.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.14 -48.84 64.27 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.336 0.655 . . . . 0.0 111.244 -178.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -60.13 -53.08 62.03 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.046 0.938 . . . . 0.0 110.389 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -60.12 -50.46 73.6 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.569 1.147 . . . . 0.0 112.437 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.68 -47.33 86.08 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.261 0.937 . . . . 0.0 112.176 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -65.31 -45.12 85.64 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.252 -0.905 . . . . 0.0 112.823 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.4 mp -56.18 -47.64 77.9 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.735 0.814 . . . . 0.0 110.535 171.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.49 -47.18 84.93 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 117.678 -1.153 . . . . 0.0 111.933 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -56.18 -50.31 71.56 Favored 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 121.609 2.004 . . . . 0.0 113.376 175.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.07 -50.35 70.94 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.796 -0.565 . . . . 0.0 112.239 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 34.2 m170 -55.97 -41.13 74.28 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-O 117.694 -1.146 . . . . 0.0 111.354 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -51.03 71.71 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 126.182 1.793 . . . . 0.0 112.398 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -58.99 -47.16 86.15 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.3 176.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.1 -51.04 63.71 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 176.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 41.5 t -59.42 -28.56 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 126.976 2.11 . . . . 0.0 112.586 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.93 -28.57 24.12 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 173.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -101.73 -0.51 34.31 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.028 1.331 . . . . 0.0 114.354 176.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 18.1 mmt -88.23 -85.73 0.18 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.594 1.158 . . . . 0.0 110.775 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -129.7 155.22 80.71 Favored Pre-proline 0 N--CA 1.476 0.853 0 C-N-CA 127.039 2.135 . . . . 0.0 112.945 -176.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.5 -51.79 0.31 Allowed 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.76 2.973 . . . . 0.0 112.846 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -62.85 -34.18 76.82 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.463 1.505 . . . . 0.0 113.217 177.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -42.61 99.75 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 118.938 -0.553 . . . . 0.0 110.437 178.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.53 -45.85 77.11 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 117.909 -1.043 . . . . 0.0 110.951 171.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 62.4 mttt -58.08 -54.76 43.35 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.122 1.328 . . . . 0.0 111.839 177.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.62 -54.98 40.73 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.452 0.701 . . . . 0.0 112.498 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.68 -46.88 77.53 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.331 1.052 . . . . 0.0 112.758 175.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.84 -43.33 99.06 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.55 1.068 . . . . 0.0 111.502 -179.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.18 -46.91 82.42 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.082 0.953 . . . . 0.0 111.881 170.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.434 ' HA ' HG22 ' A' ' 94' ' ' ILE . 6.9 mp -63.53 -32.51 73.99 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 173.52 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.3 t -73.25 -41.45 63.67 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.783 1.233 . . . . 0.0 112.571 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -71.36 -44.36 65.17 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.485 -0.759 . . . . 0.0 111.023 176.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.434 HG22 ' HA ' ' A' ' 91' ' ' LEU . 15.8 tt -69.53 -30.07 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 178.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.06 -41.78 68.53 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.134 0.879 . . . . 0.0 112.388 176.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -76.03 -27.94 57.51 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.858 1.263 . . . . 0.0 113.518 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -131.52 78.05 1.81 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.835 1.254 . . . . 0.0 111.583 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -69.67 -22.66 63.42 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.622 -1.299 . . . . 0.0 112.916 -177.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 19.4 m -62.44 -15.65 50.69 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.422 1.489 . . . . 0.0 114.339 170.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -109.03 84.06 1.86 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.823 1.249 . . . . 0.0 109.466 176.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -95.01 -174.92 3.38 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.523 1.529 . . . . 0.0 111.546 173.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 109.0 -36.98 4.03 Favored Glycine 0 N--CA 1.47 0.949 0 C-N-CA 125.238 1.399 . . . . 0.0 113.282 177.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.457 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -60.93 -27.42 41.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 CA-C-N 118.167 0.984 . . . . 0.0 111.836 174.632 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.44 -37.68 39.39 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.417 1.087 . . . . 0.0 112.94 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 26.5 mtmt -60.32 -59.41 5.45 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.599 0.76 . . . . 0.0 111.135 173.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.457 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -62.88 -36.17 82.43 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.72 0.808 . . . . 0.0 112.916 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.7 -53.23 57.58 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.42 1.088 . . . . 0.0 110.802 170.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 50.6 tttt -55.04 -50.69 68.44 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.654 0.782 . . . . 0.0 111.66 175.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 23.5 mm -51.6 -48.75 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.688 1.195 . . . . 0.0 111.059 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -64.87 -42.58 94.73 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 120.17 1.35 . . . . 0.0 113.025 177.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.94 -40.96 99.22 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.856 0.863 . . . . 0.0 112.979 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -75.88 -35.39 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 121.378 -0.827 . . . . 0.0 111.782 172.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -58.98 -43.44 91.43 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.619 1.168 . . . . 0.0 112.889 179.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.05 -23.13 67.1 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.381 -0.824 . . . . 0.0 112.331 177.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.6 m -99.19 10.51 41.29 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.745 2.018 . . . . 0.0 112.522 -176.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 39.9 mt -65.15 157.12 78.51 Favored Pre-proline 0 CA--C 1.546 0.815 0 O-C-N 120.431 -1.418 . . . . 0.0 113.126 177.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -68.46 166.45 25.6 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 123.171 2.581 . . . . 0.0 112.586 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -26.28 53.92 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 174.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.2 t -59.4 -51.65 68.98 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.629 1.104 . . . . 0.0 111.924 179.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.8 -49.19 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 O-C-N 121.706 -0.621 . . . . 0.0 109.759 173.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -58.42 -37.52 75.54 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.59 -171.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -67.85 -46.28 72.2 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.78 1.632 . . . . 0.0 113.675 170.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -59.43 -34.08 72.04 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.85 1.204 . . . . 0.0 112.959 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 3.4 pp -91.87 -20.86 21.0 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.784 1.234 . . . . 0.0 113.651 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.33 -38.74 71.75 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.745 1.157 . . . . 0.0 112.412 171.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.02 -15.89 35.15 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.682 1.193 . . . . 0.0 113.831 174.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -94.58 106.07 3.36 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 126.067 1.794 . . . . 0.0 113.635 -174.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -140.26 56.82 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 126.094 1.758 . . . . 0.0 112.616 -169.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 49.54 74.97 0.22 Allowed Glycine 0 CA--C 1.539 1.591 0 C-N-CA 125.44 1.495 . . . . 0.0 112.737 -174.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -70.11 172.26 13.3 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.57 2.847 . . . . 0.0 111.914 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 57.92 97.13 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.379 1.871 . . . . 0.0 112.762 -170.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 7.5 p -106.28 80.4 0.68 Allowed Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.928 1.691 . . . . 0.0 111.647 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.68 -1.95 11.8 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 123.716 2.944 . . . . 0.0 114.278 177.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--O 1.255 1.342 0 C-N-CA 126.782 2.033 . . . . 0.0 112.461 -176.387 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 . . . . . 0 CA--C 1.546 0.812 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -148.83 -74.92 0.17 Allowed 'General case' 0 N--CA 1.475 0.792 0 O-C-N 121.012 -1.055 . . . . 0.0 112.609 176.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -80.56 162.86 59.19 Favored Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 126.581 1.952 . . . . 0.0 113.465 179.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -69.98 166.65 27.16 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.272 2.648 . . . . 0.0 112.377 175.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -64.47 116.84 4.0 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 123.762 2.975 . . . . 0.0 111.688 176.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -71.81 -22.09 24.06 Favored 'Trans proline' 0 CA--C 1.553 1.455 0 C-N-CA 122.102 1.868 . . . . 0.0 116.469 167.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -69.88 166.45 27.7 Favored 'Trans proline' 0 C--N 1.363 1.326 0 CA-C-N 124.332 2.583 . . . . 0.0 112.276 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.422 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 40.2 Cg_endo -58.82 129.39 31.95 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.706 2.27 . . . . 0.0 110.843 171.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -48.68 -48.59 39.89 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 122.826 0.45 . . . . 0.0 111.296 172.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.583 HD23 ' H ' ' A' ' 10' ' ' LEU . 1.9 pt? -83.33 29.29 0.5 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 126.508 1.923 . . . . 0.0 114.419 178.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -37.6 104.19 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.035 1.734 . . . . 0.0 114.919 -179.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 147.55 11.0 0.18 Allowed Glycine 0 CA--C 1.542 1.741 0 C-N-CA 125.626 1.584 . . . . 0.0 115.683 -173.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -109.54 159.26 32.18 Favored Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 125.745 1.618 . . . . 0.0 112.612 -172.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -73.98 169.55 22.14 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 123.019 2.479 . . . . 0.0 113.32 179.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -54.62 -38.09 66.39 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.656 1.183 . . . . 0.0 113.267 -177.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -53.39 -39.98 64.69 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.74 1.616 . . . . 0.0 112.486 174.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.2 t -82.08 -38.96 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 C-N-CA 124.863 1.265 . . . . 0.0 112.077 176.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.7 t -56.71 -38.77 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 119.02 0.827 . . . . 0.0 111.337 176.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -62.65 -50.38 71.44 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.366 -0.834 . . . . 0.0 112.549 174.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.39 -47.76 75.35 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.083 0.953 . . . . 0.0 111.704 176.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.422 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 15.5 t80 -51.18 -52.96 39.27 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.265 1.026 . . . . 0.0 111.897 168.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -47.4 85.72 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.02 0.827 . . . . 0.0 113.124 -177.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -65.18 -37.84 88.62 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.229 0.612 . . . . 0.0 111.772 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.2 tp -59.27 -52.24 66.49 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.063 0.545 . . . . 0.0 110.884 169.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.62 -29.11 70.37 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -179.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.9 mttm -54.15 -35.56 62.37 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.349 1.431 . . . . 0.0 112.9 172.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.57 -32.8 60.52 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.29 1.036 . . . . 0.0 113.118 175.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -97.69 16.65 19.95 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.166 1.786 . . . . 0.0 113.367 179.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.6 -17.05 64.3 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 119.787 -1.82 . . . . 0.0 113.867 -170.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.7 p -100.82 1.58 40.26 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 128.051 2.54 . . . . 0.0 113.771 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -79.72 165.48 22.78 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.921 1.688 . . . . 0.0 112.592 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.89 171.02 9.89 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.962 1.705 . . . . 0.0 111.97 176.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -47.91 -59.76 5.3 Favored Pre-proline 0 N--CA 1.474 0.732 0 C-N-CA 126.343 1.857 . . . . 0.0 113.078 174.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -65.16 -30.61 55.26 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 122.118 1.879 . . . . 0.0 113.43 179.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.44 -44.95 63.89 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.639 1.175 . . . . 0.0 111.963 -178.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 80.0 mt -66.57 -53.04 39.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.702 0.801 . . . . 0.0 109.647 172.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.95 -36.49 72.61 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 118.774 0.715 . . . . 0.0 111.837 -174.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -61.41 -60.44 3.71 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 125.382 1.473 . . . . 0.0 113.687 175.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -35.62 75.74 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.823 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.8 mm? -63.79 -51.0 66.77 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.501 1.121 . . . . 0.0 112.194 172.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -57.48 -36.71 71.84 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.022 0.828 . . . . 0.0 113.141 175.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.32 -51.1 67.81 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -178.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.823 ' HE1' HD13 ' A' ' 40' ' ' LEU . 6.9 p-90 -73.92 -32.51 63.57 Favored 'General case' 0 CA--C 1.553 1.093 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 170.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.72 -31.16 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 O-C-N 120.584 -1.323 . . . . 0.0 112.017 173.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -55.95 -24.14 36.34 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.065 0.848 . . . . 0.0 112.384 177.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.59 -16.99 26.27 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.031 1.333 . . . . 0.0 113.28 177.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.703 HD11 ' CH2' ' A' ' 43' ' ' TRP . 62.8 mt -67.75 -66.83 0.51 Allowed 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 118.669 0.668 . . . . 0.0 112.485 174.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 78.77 95.19 0.28 Allowed Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.26 0.933 . . . . 0.0 112.659 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -174.32 -166.49 32.45 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 124.99 1.281 . . . . 0.0 112.232 -178.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -58.06 -12.52 3.47 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.29 1.436 . . . . 0.0 114.333 176.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -53.91 -23.5 13.02 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.944 2.098 . . . . 0.0 113.688 172.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt -52.61 -37.49 58.37 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.209 1.403 . . . . 0.0 113.675 169.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.24 81.04 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.083 0.953 . . . . 0.0 111.599 177.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -67.46 -43.44 81.06 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-O 118.689 -0.672 . . . . 0.0 111.334 172.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -57.28 -53.83 53.66 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 119.873 1.215 . . . . 0.0 112.497 172.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -58.85 -45.3 90.4 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.454 0.57 . . . . 0.0 112.041 -178.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -66.15 -42.22 89.34 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.171 0.588 . . . . 0.0 112.43 178.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -66.3 -53.51 35.72 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 118.742 0.701 . . . . 0.0 111.994 178.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.41 -40.37 68.2 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.328 0.651 . . . . 0.0 111.689 178.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.4 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 0.7 OUTLIER -60.88 -54.88 39.68 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.354 1.061 . . . . 0.0 113.29 170.292 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -56.76 -50.93 70.79 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.345 0.975 . . . . 0.0 112.746 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 ppp? -60.41 -51.76 68.09 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 176.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -56.39 -35.93 68.3 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.181 0.592 . . . . 0.0 112.478 175.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.01 -51.49 46.53 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.52 0.728 . . . . 0.0 111.155 178.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.4 tttt -60.39 -49.68 76.6 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.52 0.728 . . . . 0.0 111.001 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -61.59 -51.25 69.3 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.272 1.429 . . . . 0.0 112.506 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.94 -44.18 91.36 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.634 1.106 . . . . 0.0 112.525 176.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.81 -51.14 69.48 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.832 0.853 . . . . 0.0 111.792 177.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.6 mt -54.62 -51.16 66.23 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.261 1.024 . . . . 0.0 111.104 174.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.12 -44.38 87.72 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.214 1.006 . . . . 0.0 112.66 178.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.1 tttm -58.33 -50.66 72.85 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.81 1.244 . . . . 0.0 112.0 176.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.62 -46.42 88.35 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.644 0.778 . . . . 0.0 112.221 178.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.99 -51.33 70.1 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.817 0.847 . . . . 0.0 110.831 176.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -54.52 -46.49 73.53 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.979 1.312 . . . . 0.0 112.815 174.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -55.65 -50.1 71.13 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.669 0.788 . . . . 0.0 112.525 175.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -68.32 -30.86 69.94 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 176.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 63.3 t -72.93 -24.83 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 126.376 1.87 . . . . 0.0 113.42 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.67 -30.3 65.33 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 178.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.2 pttt -86.82 1.08 53.55 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.331 1.453 . . . . 0.0 114.492 173.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.6 ttm -103.88 -159.02 0.7 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.839 2.056 . . . . 0.0 111.568 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.47 156.63 21.75 Favored Pre-proline 0 N--CA 1.479 1.019 0 C-N-CA 125.424 1.49 . . . . 0.0 113.97 177.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.43 -46.6 1.29 Allowed 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 123.843 3.029 . . . . 0.0 113.141 -176.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -61.66 -32.12 72.27 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.784 1.233 . . . . 0.0 112.924 176.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.23 -46.98 86.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 122.751 0.42 . . . . 0.0 110.445 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.0 tppp? -55.24 -43.55 74.68 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 118.367 -0.825 . . . . 0.0 111.103 174.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? -58.47 -53.17 61.33 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.681 1.128 . . . . 0.0 112.142 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.52 -44.71 95.75 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -73.13 -39.75 65.47 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.38 -47.66 84.82 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.835 0.854 . . . . 0.0 110.532 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -51.3 -51.66 52.24 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.057 0.943 . . . . 0.0 110.941 170.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -37.37 86.07 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.543 0.611 . . . . 0.0 112.446 -179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 5.7 t -73.27 -43.59 60.77 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.199 -0.938 . . . . 0.0 112.885 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -46.52 73.72 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.367 0.667 . . . . 0.0 110.525 175.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.7 tp -66.65 -33.53 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 118.852 0.751 . . . . 0.0 112.018 -179.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.92 -31.81 72.96 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 177.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -93.18 -28.25 16.4 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 176.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -139.62 84.05 1.96 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.619 1.568 . . . . 0.0 112.523 -166.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -64.57 -9.95 22.83 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -177.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t -105.11 -5.81 20.47 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.682 1.993 . . . . 0.0 114.136 -177.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.3 mp -96.0 84.35 3.82 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.969 1.308 . . . . 0.0 110.473 -179.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -90.58 -169.81 2.51 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.291 1.437 . . . . 0.0 111.834 174.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 97.63 4.82 57.97 Favored Glycine 0 N--CA 1.477 1.39 0 C-N-CA 124.954 1.264 . . . . 0.0 115.418 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.458 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.4 OUTLIER -61.94 -25.95 38.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 118.816 1.308 . . . . 0.0 113.01 -179.871 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -53.61 -35.07 60.49 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.553 -0.717 . . . . 0.0 112.499 -179.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -56.91 -59.52 4.93 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 123.006 0.522 . . . . 0.0 111.254 171.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.458 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -65.38 -38.07 88.93 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.313 0.506 . . . . 0.0 112.066 -175.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.03 -51.4 57.7 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.951 1.3 . . . . 0.0 110.459 170.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -57.76 -48.52 79.41 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 118.348 -0.834 . . . . 0.0 112.108 175.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 35.2 mm -52.72 -52.03 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.686 1.194 . . . . 0.0 111.879 177.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 38.5 mm-40 -66.61 -38.67 87.44 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.145 1.338 . . . . 0.0 112.547 177.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.85 -37.24 81.42 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.574 0.75 . . . . 0.0 112.976 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -84.53 -30.05 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.3 1.04 . . . . 0.0 113.338 172.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -64.32 -40.11 95.24 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.447 1.099 . . . . 0.0 112.788 177.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.4 pttt -64.98 -23.54 67.25 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.482 -0.761 . . . . 0.0 112.203 176.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 39.9 p -101.32 25.55 8.15 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 126.876 2.071 . . . . 0.0 113.023 175.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.71 72.05 1.0 Allowed Pre-proline 0 CA--C 1.554 1.112 0 C-N-CA 125.637 1.575 . . . . 0.0 110.448 174.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.6 163.7 37.16 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 123.227 2.618 . . . . 0.0 112.157 176.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -58.76 -25.91 63.5 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 174.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 30.9 m -62.43 -51.63 66.78 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.865 1.211 . . . . 0.0 111.857 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 10.2 p -70.53 -39.91 76.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 121.931 -0.48 . . . . 0.0 111.406 175.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -59.19 -47.24 86.05 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.381 0.672 . . . . 0.0 111.243 178.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -68.78 -44.65 73.22 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.244 1.017 . . . . 0.0 112.642 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -63.94 -33.83 76.61 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.893 -1.13 . . . . 0.0 113.076 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.0 -24.06 23.64 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.958 0.903 . . . . 0.0 113.037 177.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -52.16 -27.84 15.89 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 126.189 1.795 . . . . 0.0 113.554 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt -54.32 -37.8 65.25 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.686 1.594 . . . . 0.0 113.865 171.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 43.23 73.22 0.25 Allowed Glycine 0 CA--C 1.54 1.603 0 C-N-CA 126.913 2.197 . . . . 0.0 115.755 175.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -114.0 61.7 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.833 1.653 . . . . 0.0 112.842 -170.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 52.57 74.9 0.25 Allowed Glycine 0 CA--C 1.541 1.692 0 C-N-CA 125.414 1.483 . . . . 0.0 113.121 -177.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -72.05 89.68 0.77 Allowed 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 124.366 3.377 . . . . 0.0 112.938 -171.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -164.24 129.62 2.86 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 128.014 2.526 . . . . 0.0 109.159 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 12.9 t -119.0 75.98 14.42 Favored Pre-proline 0 N--CA 1.478 0.929 0 C-N-CA 125.356 1.462 . . . . 0.0 109.822 171.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -74.25 177.44 8.28 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 123.755 2.97 . . . . 0.0 112.385 176.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 . . . . . 0 C--O 1.252 1.211 0 C-N-CA 125.985 1.714 . . . . 0.0 111.343 173.749 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 121.355 0.598 . . . . 0.0 112.548 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -124.89 7.04 8.03 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.809 1.644 . . . . 0.0 113.144 -177.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.8 p -101.08 160.82 25.58 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 125.851 1.66 . . . . 0.0 113.2 179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -67.11 165.75 25.41 Favored 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 123.796 2.997 . . . . 0.0 113.201 175.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -67.19 126.5 15.16 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.897 2.398 . . . . 0.0 110.989 175.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.53 -23.21 37.45 Favored 'Trans proline' 0 CA--C 1.553 1.458 0 C-N-CA 122.765 2.31 . . . . 0.0 116.768 168.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.14 167.19 24.35 Favored 'Trans proline' 0 C--N 1.361 1.227 0 CA-C-N 124.141 2.515 . . . . 0.0 113.125 175.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.418 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 40.1 Cg_endo -61.4 120.83 8.69 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.117 2.545 . . . . 0.0 111.477 172.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -51.25 -33.76 29.53 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.088 0.955 . . . . 0.0 111.669 171.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.455 ' CD2' HD12 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -101.3 34.09 2.68 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 127.04 2.136 . . . . 0.0 113.702 178.229 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.49 110.67 0.24 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.016 1.326 . . . . 0.0 113.37 179.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 145.52 11.03 0.26 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.504 1.526 . . . . 0.0 115.24 -173.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.45 158.19 40.63 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.964 1.706 . . . . 0.0 112.575 -171.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.83 170.19 20.62 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 123.228 2.619 . . . . 0.0 112.962 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -54.82 -37.92 66.73 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.494 1.117 . . . . 0.0 113.545 -178.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.45 -39.75 64.7 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.321 1.448 . . . . 0.0 112.512 173.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.5 t -80.69 -41.79 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 124.554 1.142 . . . . 0.0 112.095 175.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.1 t -55.79 -38.97 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 118.922 0.783 . . . . 0.0 111.249 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -60.62 -50.68 72.56 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.181 -0.95 . . . . 0.0 112.266 173.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.35 -47.13 76.2 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.208 1.003 . . . . 0.0 111.529 177.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.418 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -51.79 -53.79 35.95 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.677 1.191 . . . . 0.0 111.995 169.542 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -59.07 -47.51 84.99 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.681 1.128 . . . . 0.0 113.517 -178.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -68.09 -30.23 69.35 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.421 0.689 . . . . 0.0 112.298 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.7 tp -69.06 -45.36 70.57 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 121.556 -0.715 . . . . 0.0 111.646 168.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.16 -45.31 95.17 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.255 1.422 . . . . 0.0 113.943 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -24.52 54.59 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 119.36 0.982 . . . . 0.0 113.547 177.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -75.61 -36.48 60.25 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.535 1.934 . . . . 0.0 112.632 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -109.79 20.47 18.02 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.484 1.914 . . . . 0.0 112.798 178.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.9 -24.53 66.06 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 120.028 -1.67 . . . . 0.0 112.922 -174.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.67 -1.23 30.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.069 2.148 . . . . 0.0 113.797 178.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -89.75 171.7 9.45 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.745 1.618 . . . . 0.0 112.13 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.56 170.33 11.98 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 126.267 1.827 . . . . 0.0 112.041 175.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -45.45 -62.34 1.8 Allowed Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.501 1.52 . . . . 0.0 112.969 172.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.35 -35.26 24.43 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.034 1.823 . . . . 0.0 114.022 -179.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -60.57 -44.96 95.59 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.116 -0.99 . . . . 0.0 112.234 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 61.6 mt -70.95 -47.75 60.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 118.74 -0.648 . . . . 0.0 111.162 175.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -52.38 -38.75 59.67 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.023 0.829 . . . . 0.0 110.902 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -51.0 71.21 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.671 1.588 . . . . 0.0 112.394 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.64 -38.49 89.51 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.162 0.585 . . . . 0.0 111.901 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.675 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.1 mm? -62.91 -51.09 68.29 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.459 1.103 . . . . 0.0 110.988 173.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -59.75 -34.0 72.39 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.283 1.033 . . . . 0.0 113.621 176.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.3 -52.24 66.42 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.717 -0.614 . . . . 0.0 112.57 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.683 ' CH2' HD11 ' A' ' 47' ' ' LEU . 10.7 p-90 -73.74 -29.85 62.47 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 172.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.409 HG23 HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -60.64 -32.18 51.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 O-C-N 120.789 -1.194 . . . . 0.0 112.65 174.205 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -58.1 -17.82 20.76 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 175.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.57 -11.89 18.9 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.801 1.24 . . . . 0.0 113.385 177.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.683 HD11 ' CH2' ' A' ' 43' ' ' TRP . 19.9 mt -66.61 -60.84 2.35 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 175.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.78 70.64 1.15 Allowed Glycine 0 CA--C 1.538 1.48 0 C-N-CA 124.39 0.995 . . . . 0.0 113.827 -177.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -159.15 55.27 0.35 Allowed Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.119 1.342 . . . . 0.0 113.514 -178.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 74.18 -6.25 1.89 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 128.731 2.812 . . . . 0.0 114.225 -177.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -63.31 -20.93 65.92 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.863 1.665 . . . . 0.0 114.582 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -54.89 -35.55 64.21 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.969 1.708 . . . . 0.0 113.515 173.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.1 -39.04 92.58 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.64 0.776 . . . . 0.0 111.731 174.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.68 -41.49 98.16 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 118.156 -0.925 . . . . 0.0 112.063 170.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -55.24 -53.15 59.74 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.918 1.235 . . . . 0.0 112.506 173.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -61.75 -44.88 96.04 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.979 -0.45 . . . . 0.0 112.194 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.95 -38.74 83.17 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.783 -0.573 . . . . 0.0 112.311 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -65.98 -53.8 34.31 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 123.09 0.556 . . . . 0.0 111.524 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 19.9 ttpt -54.05 -40.86 67.49 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 119.197 -0.43 . . . . 0.0 111.717 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 67.6 mttt -59.0 -57.13 14.44 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.868 1.267 . . . . 0.0 113.911 169.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -53.68 -47.03 70.83 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.114 0.966 . . . . 0.0 112.254 179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -61.93 -53.27 58.06 Favored 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 123.737 0.815 . . . . 0.0 112.258 176.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -55.13 -36.15 65.45 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.122 0.569 . . . . 0.0 111.894 176.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.81 -51.51 40.02 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.008 0.923 . . . . 0.0 111.509 179.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.7 mttm -59.27 -49.39 78.01 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.338 1.055 . . . . 0.0 111.591 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.35 -54.11 50.54 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.259 1.423 . . . . 0.0 112.096 177.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.3 -44.63 96.9 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.572 1.078 . . . . 0.0 112.841 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -67.66 -45.45 75.25 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.616 -0.678 . . . . 0.0 112.389 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.49 -51.14 67.97 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.002 0.921 . . . . 0.0 110.565 170.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.02 -43.91 91.66 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.293 0.637 . . . . 0.0 112.247 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.3 tptt -56.74 -50.73 71.36 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.795 1.18 . . . . 0.0 112.161 174.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.12 -47.55 82.31 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.14 0.576 . . . . 0.0 112.194 179.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.465 ' O ' HG23 ' A' ' 77' ' ' VAL . 1.1 t-80 -56.79 -49.93 73.85 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.919 1.288 . . . . 0.0 110.744 174.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -52.67 -48.6 66.41 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.92 1.688 . . . . 0.0 111.51 177.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -56.93 -49.5 75.45 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.895 1.278 . . . . 0.0 112.654 176.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.79 -30.84 71.54 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.923 1.082 . . . . 0.0 113.923 172.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 73' ' ' HIS . 96.4 t -72.99 -24.43 20.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.967 1.307 . . . . 0.0 112.675 176.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.416 ' HB2' ' HE2' ' A' ' 85' ' ' LYS . . . -56.89 -28.73 62.24 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 176.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.7 pttt -89.82 1.41 56.19 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.156 1.382 . . . . 0.0 114.573 173.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.4 ttm -105.35 -161.62 0.82 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.795 2.038 . . . . 0.0 111.643 -172.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.9 155.66 22.43 Favored Pre-proline 0 N--CA 1.479 1.01 0 C-N-CA 124.622 1.169 . . . . 0.0 113.536 177.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.46 -42.6 3.56 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 123.387 2.725 . . . . 0.0 112.42 -178.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -63.55 -34.71 78.39 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.308 -0.87 . . . . 0.0 112.645 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.4 -41.28 93.55 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.744 0.818 . . . . 0.0 110.198 175.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.416 ' HE2' ' HB2' ' A' ' 78' ' ' ALA . 0.0 OUTLIER -55.34 -48.05 74.78 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.89 174.907 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -59.4 -52.45 65.57 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.205 1.002 . . . . 0.0 111.629 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.9 -48.69 80.68 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 177.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -70.56 -42.4 71.19 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.447 -0.783 . . . . 0.0 112.512 -176.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.92 -43.4 98.92 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.083 -1.011 . . . . 0.0 112.2 173.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -54.92 -50.09 69.66 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.481 1.112 . . . . 0.0 111.471 171.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.4 tp -59.7 -37.74 79.69 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 173.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.6 t -73.23 -40.27 64.81 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.59 -1.319 . . . . 0.0 112.923 -177.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.5 ptpm? -69.21 -43.41 74.16 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.847 -0.597 . . . . 0.0 110.779 175.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.4 tt -70.03 -33.18 54.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 119.141 0.882 . . . . 0.0 112.341 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.71 69.48 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.289 1.036 . . . . 0.0 113.426 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -111.89 -0.03 15.96 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.303 1.441 . . . . 0.0 113.442 179.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -164.79 78.06 0.33 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.05 1.74 . . . . 0.0 111.921 -175.094 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -64.0 -23.91 67.51 Favored 'General case' 0 CA--C 1.549 0.909 0 O-C-N 119.945 -1.722 . . . . 0.0 112.879 -179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 t -75.11 -7.87 54.98 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.878 1.671 . . . . 0.0 114.323 177.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -100.47 84.31 2.76 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.309 1.444 . . . . 0.0 110.376 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -90.06 171.15 9.75 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.078 1.351 . . . . 0.0 112.253 171.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 138.77 -75.53 0.37 Allowed Glycine 0 N--CA 1.474 1.176 0 C-N-CA 125.398 1.475 . . . . 0.0 112.609 175.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.528 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.4 OUTLIER -57.68 -26.29 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 118.481 1.141 . . . . 0.0 112.026 176.681 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.52 -35.3 39.97 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.692 0.797 . . . . 0.0 112.979 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -59.42 -59.36 5.58 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-O 118.967 -0.539 . . . . 0.0 111.588 171.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.528 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -64.16 -36.32 83.68 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.039 0.836 . . . . 0.0 112.707 -175.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 7.8 tm0? -51.72 -54.59 26.67 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.139 1.376 . . . . 0.0 110.791 167.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -57.52 -50.68 72.28 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 117.97 -1.014 . . . . 0.0 112.497 176.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 30.8 mm -52.17 -48.67 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.757 1.223 . . . . 0.0 111.556 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -67.51 -44.22 78.95 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.416 -0.803 . . . . 0.0 112.744 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.8 -37.84 83.34 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.084 0.953 . . . . 0.0 112.819 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.6 pp -79.34 -34.24 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.021 0.928 . . . . 0.0 112.472 170.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -61.5 -37.22 82.88 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.957 1.253 . . . . 0.0 113.342 177.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -15.62 63.4 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.971 -1.081 . . . . 0.0 112.733 175.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 3.9 t -131.28 39.01 3.58 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.924 2.089 . . . . 0.0 112.222 -176.045 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 16.0 mt -51.34 147.99 9.44 Favored Pre-proline 0 CA--C 1.548 0.883 0 C-N-CA 124.218 1.007 . . . . 0.0 112.48 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -65.19 156.43 63.01 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 122.706 2.271 . . . . 0.0 112.49 -172.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -59.24 -24.88 63.56 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 12.7 t -63.0 -51.74 65.69 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.338 0.972 . . . . 0.0 111.875 175.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.7 p -72.89 -39.28 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 O-C-N 121.857 -0.527 . . . . 0.0 111.353 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -57.38 -50.18 73.81 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.11 0.868 . . . . 0.0 111.734 173.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -66.03 -43.43 87.6 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 119.934 1.243 . . . . 0.0 112.126 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -63.46 -33.63 75.99 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 120.57 -1.331 . . . . 0.0 113.067 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.22 -22.69 22.63 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.208 1.003 . . . . 0.0 113.151 178.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -56.99 -14.8 3.93 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 126.865 2.066 . . . . 0.0 114.137 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -23.96 55.84 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.132 1.773 . . . . 0.0 113.741 166.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -166.73 105.91 0.25 Allowed Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.337 0.97 . . . . 0.0 114.123 -176.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -132.12 63.91 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 126.588 1.955 . . . . 0.0 112.318 -174.378 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 47.84 74.76 0.23 Allowed Glycine 0 CA--C 1.544 1.847 0 C-N-CA 125.825 1.678 . . . . 0.0 113.588 -175.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -69.99 124.33 10.88 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.858 3.039 . . . . 0.0 112.624 -172.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -159.81 71.98 0.5 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.392 1.477 . . . . 0.0 111.666 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 11.5 t -131.19 78.17 73.17 Favored Pre-proline 0 N--CA 1.481 1.08 0 C-N-CA 124.568 1.147 . . . . 0.0 110.53 176.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -76.06 -5.24 16.1 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.862 3.041 . . . . 0.0 114.509 177.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.215 0 C-N-CA 127.371 2.268 . . . . 0.0 112.752 176.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 . . . . . 0 N--CA 1.477 0.901 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -152.18 95.05 2.01 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.581 1.552 . . . . 0.0 111.448 -178.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.2 p -69.46 158.23 87.39 Favored Pre-proline 0 N--CA 1.478 0.944 0 O-C-N 121.012 -1.055 . . . . 0.0 112.668 172.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -68.86 166.86 24.92 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.354 2.702 . . . . 0.0 112.244 176.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -64.88 116.51 3.86 Favored 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 123.025 2.483 . . . . 0.0 111.478 176.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -70.44 -22.59 28.76 Favored 'Trans proline' 0 CA--C 1.554 1.478 0 C-N-CA 122.041 1.827 . . . . 0.0 116.279 166.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -70.19 167.75 24.09 Favored 'Trans proline' 0 C--N 1.363 1.3 0 CA-C-N 124.078 2.492 . . . . 0.0 112.913 179.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -61.37 126.77 20.07 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.934 2.423 . . . . 0.0 110.467 172.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -56.73 -43.43 80.65 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 122.062 -0.399 . . . . 0.0 110.644 173.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.468 HD23 ' H ' ' A' ' 10' ' ' LEU . 2.0 pt? -72.59 16.09 0.16 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 126.778 2.031 . . . . 0.0 116.453 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -35.34 106.71 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.804 2.041 . . . . 0.0 114.724 -174.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.87 30.59 0.17 Allowed Glycine 0 CA--C 1.537 1.458 0 C-N-CA 124.885 1.231 . . . . 0.0 114.837 -172.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -124.72 157.5 65.71 Favored Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 125.487 1.515 . . . . 0.0 111.925 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.412 ' O ' HG23 ' A' ' 18' ' ' VAL . 77.4 Cg_endo -73.18 168.15 25.48 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.304 2.669 . . . . 0.0 112.858 -179.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -52.9 -37.47 60.66 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.667 1.187 . . . . 0.0 113.224 -178.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -57.92 -37.97 75.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.13 1.372 . . . . 0.0 112.643 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 84.6 t -80.12 -40.37 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.116 1.366 . . . . 0.0 111.481 173.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 14' ' ' PRO . 32.2 t -57.02 -37.31 54.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.493 0.717 . . . . 0.0 111.15 178.038 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.9 tppt? -59.26 -50.18 75.0 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 120.545 -1.347 . . . . 0.0 112.223 174.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.15 -46.92 87.12 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.434 0.693 . . . . 0.0 111.263 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -51.97 60.24 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.145 0.978 . . . . 0.0 112.154 170.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -59.56 -47.49 85.36 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.609 1.095 . . . . 0.0 112.789 -178.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -63.92 -37.04 85.93 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.583 0.753 . . . . 0.0 111.932 177.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.7 tp -66.38 -43.92 84.59 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.406 0.682 . . . . 0.0 112.166 173.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.71 -49.1 69.72 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.927 1.291 . . . . 0.0 113.543 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.3 pttt -56.31 -30.75 62.94 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.234 0.925 . . . . 0.0 113.017 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -65.92 -40.65 91.62 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.739 2.016 . . . . 0.0 112.345 174.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -109.73 28.28 8.72 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.568 1.947 . . . . 0.0 112.671 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -66.62 -24.65 66.34 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 119.888 -1.757 . . . . 0.0 112.374 -175.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.7 p -80.22 4.24 18.19 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 127.729 2.411 . . . . 0.0 114.361 177.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -87.51 170.92 10.92 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.431 1.492 . . . . 0.0 112.167 177.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.82 172.17 8.51 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 126.851 2.061 . . . . 0.0 111.643 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -51.16 -58.65 9.75 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.063 1.345 . . . . 0.0 112.591 176.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -68.67 -32.04 24.79 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 121.436 1.424 . . . . 0.0 113.128 178.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -65.89 -46.76 77.18 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 121.03 -1.044 . . . . 0.0 112.547 178.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 90.3 mt -65.66 -53.43 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 123.216 0.606 . . . . 0.0 109.555 175.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.09 -36.68 77.93 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 118.122 0.419 . . . . 0.0 112.007 -173.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.4 tttm -57.06 -57.07 14.17 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 126.008 1.723 . . . . 0.0 112.695 171.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -60.82 -40.43 92.71 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 122.871 0.468 . . . . 0.0 111.835 -177.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.725 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.1 mm? -59.01 -51.11 71.47 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.12 0.968 . . . . 0.0 111.101 171.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -62.93 -31.76 72.91 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -179.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.29 -52.01 67.08 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.58 0.752 . . . . 0.0 112.372 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.725 ' HE1' HD13 ' A' ' 40' ' ' LEU . 10.6 p-90 -73.29 -30.97 63.77 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 172.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.413 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -59.13 -31.76 46.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 125.072 1.349 . . . . 0.0 112.596 174.023 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -57.83 -21.41 42.23 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 118.717 0.689 . . . . 0.0 112.716 174.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.38 -16.99 22.97 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.35 1.06 . . . . 0.0 112.941 178.3 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.647 HD11 ' CH2' ' A' ' 43' ' ' TRP . 22.8 mt -62.22 -63.04 1.36 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 178.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.29 101.46 0.76 Allowed Glycine 0 CA--C 1.533 1.167 0 C-N-CA 124.162 0.887 . . . . 0.0 112.138 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 161.35 -154.6 25.62 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.959 1.266 . . . . 0.0 112.145 -177.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -55.31 -19.81 9.69 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.894 1.277 . . . . 0.0 113.434 177.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -53.47 -23.2 9.48 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.58 1.952 . . . . 0.0 114.48 172.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -34.56 67.95 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.338 1.055 . . . . 0.0 113.286 173.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.0 -36.6 83.73 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.203 1.001 . . . . 0.0 110.953 176.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.41 ' HA ' HG22 ' A' ' 57' ' ' THR . 0.0 OUTLIER -63.0 -35.11 79.13 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 117.704 -1.141 . . . . 0.0 112.429 171.344 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -66.72 -54.06 26.96 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 120.148 1.34 . . . . 0.0 112.331 174.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -59.82 -43.07 94.74 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 122.145 -0.347 . . . . 0.0 111.556 -178.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.41 HG22 ' HA ' ' A' ' 54' ' ' LYS . 0.7 OUTLIER -70.2 -38.39 75.32 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.202 1.001 . . . . 0.0 112.602 177.503 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -56.59 -53.43 57.74 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.958 1.303 . . . . 0.0 110.511 174.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.64 -50.17 44.22 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.517 0.727 . . . . 0.0 110.892 -179.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.6 mmtm -61.95 -55.41 29.79 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.668 1.587 . . . . 0.0 113.573 175.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -54.24 -49.98 68.25 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.639 1.176 . . . . 0.0 112.142 179.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.9 tmm? -64.31 -51.74 61.97 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 123.982 0.913 . . . . 0.0 112.537 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 23.5 mttm -54.49 -34.99 62.63 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.22 -51.55 30.0 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.943 0.792 . . . . 0.0 111.722 178.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.8 -50.06 75.38 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.093 0.957 . . . . 0.0 110.832 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.07 -51.08 70.69 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.151 1.38 . . . . 0.0 112.133 178.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.8 -50.39 72.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 120.166 1.348 . . . . 0.0 112.555 176.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.67 -50.73 71.31 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.705 0.802 . . . . 0.0 112.475 178.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.1 tp -55.07 -49.65 71.11 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.213 1.405 . . . . 0.0 111.258 175.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.78 -44.16 97.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.825 1.25 . . . . 0.0 111.592 178.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.0 tttp -57.52 -50.22 73.8 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.773 1.17 . . . . 0.0 111.983 175.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.31 -49.7 74.59 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.662 0.785 . . . . 0.0 112.751 176.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.4 m80 -54.76 -50.84 67.44 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.635 0.774 . . . . 0.0 111.572 173.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -53.7 -47.92 70.04 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.836 1.654 . . . . 0.0 112.887 176.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.17 -48.43 73.77 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.014 0.926 . . . . 0.0 112.122 174.113 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.04 77.78 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 50.3 t -69.6 -26.03 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 126.167 1.787 . . . . 0.0 112.365 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -53.22 -31.78 44.92 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 173.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.3 pttt -93.2 -1.19 56.49 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 176.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -90.85 -81.37 0.31 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.425 1.09 . . . . 0.0 110.711 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.64 153.71 80.79 Favored Pre-proline 0 N--CA 1.481 1.078 0 C-N-CA 126.96 2.104 . . . . 0.0 113.273 -173.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.59 -48.24 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.828 3.018 . . . . 0.0 113.191 -178.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -66.73 -34.41 77.77 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.284 1.034 . . . . 0.0 112.389 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.71 -34.62 78.62 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.568 0.747 . . . . 0.0 111.921 178.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.33 -53.31 52.92 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 118.996 0.816 . . . . 0.0 109.837 170.034 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.1 mttt -59.84 -47.39 85.91 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.358 0.663 . . . . 0.0 111.053 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.63 -54.46 46.22 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.431 1.092 . . . . 0.0 113.43 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.41 -35.73 79.86 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.2 -0.937 . . . . 0.0 112.488 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.45 -45.78 71.57 Favored 'General case' 0 N--CA 1.463 0.2 0 O-C-N 121.473 -0.767 . . . . 0.0 110.941 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -52.62 -51.96 57.63 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.193 0.997 . . . . 0.0 111.261 168.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 7.0 tp -58.65 -37.18 75.41 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 119.286 0.948 . . . . 0.0 112.042 177.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.7 t -70.18 -48.23 58.11 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.066 -1.021 . . . . 0.0 112.581 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.3 ptpt -69.5 -36.28 76.33 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.789 0.836 . . . . 0.0 111.671 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.2 tp -72.34 -32.04 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 118.629 0.649 . . . . 0.0 111.77 176.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.27 -21.54 65.29 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 -177.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.26 15.15 19.39 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.708 1.603 . . . . 0.0 113.236 176.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -57.51 119.85 7.25 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.215 1.406 . . . . 0.0 113.728 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -102.33 -47.35 4.52 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.372 -0.83 . . . . 0.0 112.296 176.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 t -123.56 -0.93 8.59 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.403 1.481 . . . . 0.0 113.983 177.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.3 mp -67.83 161.29 26.57 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.719 1.207 . . . . 0.0 112.037 177.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -96.34 179.15 5.13 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.351 1.06 . . . . 0.0 111.054 176.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.87 56.64 2.2 Favored Glycine 0 N--CA 1.471 1.032 0 C-N-CA 125.571 1.558 . . . . 0.0 113.934 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.559 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -52.63 -24.42 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 125.778 1.631 . . . . 0.0 112.884 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.91 -35.35 6.36 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.35 1.06 . . . . 0.0 112.738 174.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.8 pttt -57.35 -53.48 57.63 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.356 1.462 . . . . 0.0 112.494 171.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.559 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -69.03 -33.77 74.15 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 120.294 1.406 . . . . 0.0 111.895 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -59.09 -54.7 44.07 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 173.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.0 pttm -59.38 -42.77 92.45 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.529 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.5 mm -55.72 -48.52 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.325 1.05 . . . . 0.0 111.256 175.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -62.3 -45.35 93.66 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.237 1.381 . . . . 0.0 112.609 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.22 -35.47 81.16 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.584 0.754 . . . . 0.0 112.525 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.3 pt -79.31 -36.29 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 118.737 0.699 . . . . 0.0 112.208 170.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -59.15 -41.04 87.38 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.278 1.431 . . . . 0.0 112.024 179.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.7 -14.49 63.05 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.193 -0.942 . . . . 0.0 113.306 176.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 2.6 t -132.56 26.57 4.4 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.087 1.755 . . . . 0.0 113.936 -175.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.458 HD22 HG11 ' A' ' 120' ' ' VAL . 13.0 mt -47.43 145.79 3.77 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 125.809 1.644 . . . . 0.0 112.465 -178.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -63.82 155.52 63.34 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.629 2.219 . . . . 0.0 111.688 -177.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -58.47 -25.54 62.39 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 121.608 -0.682 . . . . 0.0 112.801 175.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.7 m -61.56 -51.61 67.87 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.38 1.445 . . . . 0.0 112.197 177.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.458 HG11 HD22 ' A' ' 116' ' ' LEU . 9.4 p -75.3 -38.77 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.752 -0.593 . . . . 0.0 111.793 178.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -57.69 -48.33 79.83 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 118.911 0.778 . . . . 0.0 111.999 172.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.68 -39.55 73.47 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.511 1.05 . . . . 0.0 112.806 178.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -66.31 -34.81 78.83 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.675 1.125 . . . . 0.0 112.442 177.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.65 -21.55 25.22 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.108 0.963 . . . . 0.0 113.219 178.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -55.17 -22.09 15.94 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.657 1.583 . . . . 0.0 113.864 179.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 26.2 mttm -56.28 -34.48 66.48 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 126.659 1.983 . . . . 0.0 113.076 170.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -174.41 133.96 2.67 Favored Glycine 0 CA--C 1.537 1.43 0 C-N-CA 124.193 0.901 . . . . 0.0 114.424 -178.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -114.69 66.91 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 126.92 2.088 . . . . 0.0 111.358 -169.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 47.99 74.84 0.22 Allowed Glycine 0 CA--C 1.54 1.628 0 C-N-CA 126.168 1.842 . . . . 0.0 113.245 -173.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -67.81 136.55 39.0 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.074 2.516 . . . . 0.0 111.812 -175.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -145.05 100.54 3.5 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.157 1.383 . . . . 0.0 110.397 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 17.4 t -123.73 75.79 56.07 Favored Pre-proline 0 N--CA 1.476 0.84 0 C-N-CA 124.671 1.188 . . . . 0.0 109.728 177.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -73.93 -7.67 20.27 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.584 2.856 . . . . 0.0 114.213 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.288 0 C-N-CA 126.906 2.082 . . . . 0.0 111.898 -179.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 CA--C 1.54 0.562 0 CA-C-O 121.548 0.69 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -149.93 165.66 31.94 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.128 1.771 . . . . 0.0 110.605 169.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.1 p -64.43 158.99 63.06 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 123.674 0.79 . . . . 0.0 112.261 171.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -68.36 164.11 33.84 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.888 2.392 . . . . 0.0 111.833 177.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -64.04 116.72 3.88 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 123.313 2.675 . . . . 0.0 111.731 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -71.25 -21.98 26.13 Favored 'Trans proline' 0 CA--C 1.554 1.478 0 C-N-CA 122.171 1.914 . . . . 0.0 116.5 167.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -70.28 166.53 27.92 Favored 'Trans proline' 0 C--N 1.362 1.268 0 CA-C-N 124.25 2.554 . . . . 0.0 112.873 178.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.31 126.86 19.49 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.814 2.343 . . . . 0.0 110.418 173.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -60.31 -33.81 72.9 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 119.807 -0.757 . . . . 0.0 111.419 174.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.458 HD23 ' H ' ' A' ' 10' ' ' LEU . 1.6 pt? -77.91 17.26 0.6 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 127.33 2.252 . . . . 0.0 115.902 172.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -38.49 105.37 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.029 1.731 . . . . 0.0 114.922 -173.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 147.69 24.17 0.08 OUTLIER Glycine 0 CA--C 1.539 1.581 0 C-N-CA 124.864 1.221 . . . . 0.0 115.296 -172.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.96 158.97 46.53 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 125.098 1.359 . . . . 0.0 112.542 -173.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.415 ' O ' HG23 ' A' ' 18' ' ' VAL . 88.5 Cg_endo -73.46 167.29 27.67 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.196 2.598 . . . . 0.0 112.755 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -50.99 -40.7 58.57 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.503 1.521 . . . . 0.0 113.264 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -56.93 -37.48 71.55 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.48 1.512 . . . . 0.0 113.058 176.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.0 t -81.77 -41.11 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 125.0 1.32 . . . . 0.0 111.634 174.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 14' ' ' PRO . 39.6 t -57.5 -36.94 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 123.956 0.902 . . . . 0.0 111.34 178.166 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.5 tptt -64.03 -43.22 96.26 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 172.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.77 -45.42 94.4 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.347 0.659 . . . . 0.0 110.54 175.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.76 -46.29 84.75 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-O 117.475 -1.25 . . . . 0.0 113.646 171.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -63.56 -47.02 83.26 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 120.192 1.36 . . . . 0.0 112.739 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.34 -38.25 88.78 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.02 0.928 . . . . 0.0 111.621 177.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.0 tp -63.89 -46.97 82.5 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 122.898 0.479 . . . . 0.0 111.46 171.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.44 -45.76 92.5 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.117 1.367 . . . . 0.0 114.443 -178.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -58.41 -28.26 65.05 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.664 1.12 . . . . 0.0 113.608 175.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -76.28 -32.61 58.9 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.503 1.521 . . . . 0.0 113.59 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -108.08 19.6 19.77 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.368 1.467 . . . . 0.0 114.197 176.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -57.79 -28.79 64.32 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 119.948 -1.72 . . . . 0.0 113.247 -177.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.7 m -77.18 -2.27 33.62 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.379 1.872 . . . . 0.0 113.767 179.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -83.21 167.28 17.85 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.381 1.472 . . . . 0.0 112.613 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.0 172.78 9.31 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 126.556 1.942 . . . . 0.0 112.213 177.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -50.77 -59.89 6.55 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 126.159 1.784 . . . . 0.0 112.913 175.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -67.8 -32.65 29.17 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.636 1.558 . . . . 0.0 112.974 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.65 -49.98 71.09 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.05 -1.032 . . . . 0.0 112.517 177.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 94.1 mt -61.93 -53.53 46.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 123.215 0.606 . . . . 0.0 110.228 174.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -58.52 -40.36 82.7 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 118.319 0.509 . . . . 0.0 112.342 -174.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.31 -54.22 49.22 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.412 1.885 . . . . 0.0 112.479 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.96 -41.12 97.63 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.738 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.9 mm? -59.36 -51.07 71.48 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 124.007 0.923 . . . . 0.0 113.033 171.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.61 -36.06 79.65 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 176.264 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.52 -50.33 73.42 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.159 0.89 . . . . 0.0 112.231 -177.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.738 ' HE1' HD13 ' A' ' 40' ' ' LEU 0.268 8.5 p-90 -69.24 -36.99 77.74 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 170.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.425 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -58.2 -31.19 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 125.109 1.364 . . . . 0.0 113.62 176.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -57.24 -17.66 12.6 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 175.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.35 -15.47 20.71 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.178 1.391 . . . . 0.0 113.689 176.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.677 HD11 ' CH2' ' A' ' 43' ' ' TRP . 32.6 mt -66.68 -61.23 2.08 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 118.899 0.772 . . . . 0.0 112.869 175.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.49 104.08 1.1 Allowed Glycine 0 CA--C 1.532 1.154 0 C-N-CA 124.007 0.813 . . . . 0.0 112.188 -177.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 166.73 -166.91 39.33 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.508 1.528 . . . . 0.0 111.724 -177.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -56.29 -18.26 10.11 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.42 1.088 . . . . 0.0 113.758 178.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -52.7 -27.81 19.11 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.752 2.021 . . . . 0.0 113.681 174.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -55.07 -36.55 65.73 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.061 1.344 . . . . 0.0 113.299 173.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.51 -52.49 64.28 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.389 1.075 . . . . 0.0 110.523 174.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.84 -42.91 48.4 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 117.244 -1.36 . . . . 0.0 112.009 172.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -55.33 -52.82 62.26 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.657 1.117 . . . . 0.0 112.425 173.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -58.94 -41.12 86.63 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.776 -0.577 . . . . 0.0 112.487 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.67 -43.61 72.18 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.212 1.005 . . . . 0.0 113.373 175.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -54.36 -47.05 73.06 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.664 1.186 . . . . 0.0 110.663 174.131 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.1 ttpp -52.8 -51.37 61.06 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 118.639 0.654 . . . . 0.0 111.633 -178.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.65 -53.53 53.19 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.329 1.052 . . . . 0.0 113.604 173.196 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -56.92 -49.44 75.61 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.413 1.006 . . . . 0.0 112.142 -178.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -65.03 -51.57 60.82 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.608 1.163 . . . . 0.0 112.348 177.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 22.0 mtmt -54.97 -34.06 62.98 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.994 0.815 . . . . 0.0 112.668 172.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.39 -48.31 50.7 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 119.693 1.133 . . . . 0.0 111.767 178.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.45 -52.27 65.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.013 0.925 . . . . 0.0 110.66 177.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -59.01 -49.89 76.18 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.873 1.269 . . . . 0.0 112.259 178.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.1 -45.45 94.65 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.339 0.972 . . . . 0.0 112.014 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -63.43 -49.78 72.36 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 118.762 0.71 . . . . 0.0 111.674 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.8 mt -56.27 -50.02 72.55 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.045 1.338 . . . . 0.0 111.36 174.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -64.08 -41.68 97.22 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 118.569 -0.729 . . . . 0.0 112.249 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -59.2 -50.61 73.35 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.792 1.178 . . . . 0.0 111.719 176.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.79 -50.07 73.82 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.119 0.967 . . . . 0.0 113.091 175.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -57.05 -52.31 65.78 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 118.716 -0.659 . . . . 0.0 111.515 174.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -55.12 -44.16 74.76 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.537 1.535 . . . . 0.0 112.908 177.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.59 -52.32 64.17 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.246 1.019 . . . . 0.0 112.709 172.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.2 -33.34 75.17 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.534 0.606 . . . . 0.0 112.505 177.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 56.0 t -72.65 -25.46 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.242 1.817 . . . . 0.0 112.301 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.45 -33.02 58.78 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 175.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.4 pttt -90.25 -0.69 57.74 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.511 1.524 . . . . 0.0 114.289 173.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 tpp -95.26 -159.22 0.7 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.612 1.965 . . . . 0.0 111.89 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -58.38 156.84 20.09 Favored Pre-proline 0 N--CA 1.478 0.953 0 C-N-CA 126.313 1.845 . . . . 0.0 114.334 176.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -71.75 -43.04 1.42 Allowed 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.85 3.034 . . . . 0.0 113.537 -175.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -58.98 -36.59 75.13 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.668 1.187 . . . . 0.0 111.765 174.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.86 -42.47 90.38 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.488 0.715 . . . . 0.0 110.321 179.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.91 -46.45 71.44 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.302 1.041 . . . . 0.0 111.799 173.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -62.97 -51.95 64.88 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.509 1.123 . . . . 0.0 112.083 178.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.07 -55.66 30.22 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.47 0.708 . . . . 0.0 112.02 176.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.75 -31.17 71.64 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.98 77.1 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.751 1.16 . . . . 0.0 111.275 171.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -42.59 94.63 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 174.428 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.412 ' HA ' HG22 ' A' ' 94' ' ' ILE . 3.4 mm? -63.97 -39.41 94.06 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 118.979 0.808 . . . . 0.0 113.121 174.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 17.0 t -71.6 -39.59 70.42 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 120.952 -1.092 . . . . 0.0 111.856 -177.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.04 -37.57 64.26 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 118.831 -0.604 . . . . 0.0 112.17 176.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.412 HG22 ' HA ' ' A' ' 91' ' ' LEU . 10.4 tt -72.99 -32.25 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-N 119.133 0.879 . . . . 0.0 112.972 177.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.78 -22.69 64.35 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -94.17 -9.58 35.93 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.142 1.377 . . . . 0.0 113.613 173.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -144.18 92.06 2.28 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.234 1.814 . . . . 0.0 113.302 -174.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -70.59 -8.16 49.49 Favored 'General case' 0 CA--C 1.55 0.98 0 O-C-N 120.588 -1.32 . . . . 0.0 114.545 173.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.6 t -72.73 -11.6 60.68 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.382 1.473 . . . . 0.0 114.269 178.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 45.8 mt -72.8 165.8 24.15 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.634 1.573 . . . . 0.0 112.925 177.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -73.85 177.07 5.79 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.823 1.249 . . . . 0.0 112.582 174.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.03 44.26 0.54 Allowed Glycine 0 N--CA 1.474 1.214 0 C-N-CA 126.027 1.775 . . . . 0.0 114.593 173.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -59.75 -34.96 57.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 118.807 1.303 . . . . 0.0 110.901 -178.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -55.66 -37.62 68.5 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.775 1.23 . . . . 0.0 113.009 -174.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -61.25 -58.7 7.23 Favored 'General case' 0 C--N 1.346 0.45 0 C-N-CA 124.627 1.171 . . . . 0.0 112.428 170.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.96 77.62 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.057 1.343 . . . . 0.0 113.312 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -56.6 -52.19 65.8 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.091 1.356 . . . . 0.0 111.527 168.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.88 -48.04 64.26 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 118.791 -0.624 . . . . 0.0 111.675 173.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 7.1 mm -58.31 -52.22 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 118.849 0.749 . . . . 0.0 111.407 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -63.57 -36.98 85.58 Favored 'General case' 0 C--O 1.242 0.683 0 O-C-N 121.501 -0.749 . . . . 0.0 112.782 178.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.64 -41.54 83.69 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.312 -1.328 . . . . 0.0 113.016 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.4 pt -75.14 -33.31 28.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 O-C-N 121.464 -0.773 . . . . 0.0 110.95 177.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -63.89 -48.38 76.87 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.235 -0.915 . . . . 0.0 111.598 176.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 12.2 mmtp -61.77 -25.03 67.22 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.224 1.01 . . . . 0.0 112.414 174.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 25.3 m -70.11 -44.7 68.43 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 118.836 0.744 . . . . 0.0 112.071 176.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 27.0 mt -60.06 151.39 66.17 Favored Pre-proline 0 CA--C 1.549 0.904 0 C-N-CA 124.047 0.939 . . . . 0.0 112.736 -178.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -67.52 157.51 61.42 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.804 2.336 . . . . 0.0 112.608 -175.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -22.04 66.86 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.539 -0.726 . . . . 0.0 112.523 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 49.9 m -64.91 -48.62 73.51 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 173.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.1 p -74.88 -37.16 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 119.002 0.819 . . . . 0.0 110.485 177.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -57.6 -50.41 73.22 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.963 0.801 . . . . 0.0 111.991 171.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -63.23 -44.0 96.51 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.49 1.041 . . . . 0.0 112.996 178.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -66.59 -32.83 74.41 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.482 -0.761 . . . . 0.0 112.714 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.92 -22.79 21.81 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.192 0.997 . . . . 0.0 113.682 178.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -52.77 -40.93 63.61 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.719 1.608 . . . . 0.0 111.953 176.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.08 6.48 47.53 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.682 1.593 . . . . 0.0 114.672 174.156 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -100.73 82.1 0.49 Allowed Glycine 0 CA--C 1.533 1.179 0 C-N-CA 126.508 2.004 . . . . 0.0 112.753 -177.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -128.09 68.38 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 C-N-CA 125.852 1.661 . . . . 0.0 110.961 -176.534 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 53.45 75.22 0.24 Allowed Glycine 0 CA--C 1.561 2.916 0 C-N-CA 126.124 1.821 . . . . 0.0 110.965 176.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.11 164.16 33.69 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 122.507 2.138 . . . . 0.0 112.133 -175.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -154.72 109.32 3.01 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.625 1.97 . . . . 0.0 111.081 -178.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 32.1 t -137.05 132.04 18.04 Favored Pre-proline 0 N--CA 1.48 1.056 0 C-N-CA 125.877 1.671 . . . . 0.0 110.211 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -72.27 174.93 10.69 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 123.974 3.116 . . . . 0.0 113.129 175.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.286 0 N-CA-C 113.809 1.041 . . . . 0.0 113.809 174.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 . . . . . 0 CA--C 1.538 0.518 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -64.26 166.45 8.0 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.781 0.833 . . . . 0.0 111.978 170.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -58.43 154.79 31.29 Favored Pre-proline 0 N--CA 1.473 0.708 0 C-N-CA 123.875 0.87 . . . . 0.0 112.695 173.32 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -67.7 168.69 17.75 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 123.363 2.709 . . . . 0.0 112.276 178.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -64.95 116.01 3.59 Favored 'Trans proline' 0 CA--C 1.545 1.035 0 C-N-CA 122.896 2.397 . . . . 0.0 111.678 175.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -70.39 -23.47 27.89 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 CA-C-O 115.292 -2.045 . . . . 0.0 115.927 164.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -72.3 167.72 26.14 Favored 'Trans proline' 0 C--N 1.362 1.282 0 CA-C-N 124.596 2.677 . . . . 0.0 113.017 179.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -63.35 127.2 19.42 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.991 2.461 . . . . 0.0 112.053 177.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -62.32 -14.78 43.03 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 172.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.432 ' N ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -118.96 36.01 4.61 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 129.029 2.932 . . . . 0.0 112.409 177.236 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.89 109.82 0.19 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.682 1.593 . . . . 0.0 113.123 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.23 -19.4 1.37 Allowed Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.749 1.643 . . . . 0.0 114.069 -176.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.9 160.9 81.37 Favored Pre-proline 0 CA--C 1.558 1.276 0 C-N-CA 125.646 1.578 . . . . 0.0 113.753 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -75.68 171.54 18.0 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.921 3.081 . . . . 0.0 113.669 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -53.38 -35.17 60.04 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.619 1.168 . . . . 0.0 113.944 -178.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -54.35 -42.1 69.87 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.51 1.524 . . . . 0.0 112.068 174.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -77.81 -43.0 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 125.355 1.462 . . . . 0.0 112.099 173.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 88.3 t -55.29 -36.82 41.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 118.806 0.73 . . . . 0.0 111.352 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.7 tptm -62.96 -50.49 70.58 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.987 -1.071 . . . . 0.0 112.24 172.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -55.03 -48.34 73.54 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.467 0.707 . . . . 0.0 111.798 177.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -53.58 -52.42 59.81 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.738 1.215 . . . . 0.0 112.149 171.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -60.04 -47.51 85.56 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.571 1.078 . . . . 0.0 113.076 -179.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -63.71 -36.34 83.55 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.676 0.79 . . . . 0.0 111.732 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.7 tp -66.25 -46.06 78.41 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.372 0.669 . . . . 0.0 111.829 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -63.49 -45.97 88.29 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.843 1.257 . . . . 0.0 114.024 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -33.53 70.92 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 120.048 1.295 . . . . 0.0 113.461 177.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -69.1 -33.41 73.46 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.396 1.878 . . . . 0.0 112.95 173.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -107.04 20.34 19.17 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.019 2.128 . . . . 0.0 112.895 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -64.4 -25.51 68.05 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 119.775 -1.828 . . . . 0.0 112.762 -174.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.3 -5.01 59.0 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 127.142 2.177 . . . . 0.0 113.335 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.2 mmtt -76.09 -177.71 4.07 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.332 1.453 . . . . 0.0 112.906 178.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.77 172.77 6.67 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 128.082 2.553 . . . . 0.0 111.705 -177.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -49.96 -59.83 6.23 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 125.28 1.432 . . . . 0.0 112.426 176.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.45 -32.91 18.89 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 121.613 1.542 . . . . 0.0 113.261 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.48 -48.06 81.25 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.063 -1.023 . . . . 0.0 111.955 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 54.2 mt -66.1 -52.27 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.278 0.631 . . . . 0.0 110.02 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -57.08 -41.12 78.26 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.69 0.677 . . . . 0.0 111.814 -177.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -52.35 65.98 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.294 1.438 . . . . 0.0 112.917 174.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -62.25 -42.47 99.35 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.638 HD13 ' HE1' ' A' ' 43' ' ' TRP . 2.0 mm? -60.1 -49.73 76.49 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.295 1.038 . . . . 0.0 110.979 173.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.8 -35.44 76.5 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 176.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.73 -49.36 76.81 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.447 -0.783 . . . . 0.0 112.339 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.638 ' HE1' HD13 ' A' ' 40' ' ' LEU . 9.9 p-90 -73.17 -32.94 65.15 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.959 1.096 . . . . 0.0 113.959 172.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.416 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -58.39 -30.68 41.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 125.507 1.523 . . . . 0.0 112.987 174.274 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.84 -19.28 16.57 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 118.803 0.729 . . . . 0.0 112.907 174.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.27 -18.54 22.36 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.799 1.24 . . . . 0.0 113.795 175.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.61 HD11 ' CH2' ' A' ' 43' ' ' TRP . 33.0 mt -65.45 -61.98 1.79 Allowed 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 178.236 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.61 98.85 0.73 Allowed Glycine 0 CA--C 1.534 1.234 0 C-N-CA 123.937 0.779 . . . . 0.0 112.211 -177.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 173.66 -166.34 38.57 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 125.266 1.412 . . . . 0.0 111.876 -177.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -56.14 -17.97 8.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.688 1.195 . . . . 0.0 113.865 177.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -55.19 -23.28 21.12 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.79 2.036 . . . . 0.0 113.859 173.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.8 pttt -54.58 -37.49 65.58 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.269 1.427 . . . . 0.0 113.07 171.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.74 -52.49 63.02 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.738 0.815 . . . . 0.0 110.077 174.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.82 -45.15 29.51 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 118.126 -0.94 . . . . 0.0 111.998 172.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -56.2 -52.42 64.48 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.835 0.854 . . . . 0.0 112.426 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.08 -44.02 91.85 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.65 -0.656 . . . . 0.0 111.924 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.61 -40.08 92.23 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.975 0.91 . . . . 0.0 113.278 175.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.5 -53.23 59.93 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.216 1.006 . . . . 0.0 111.053 172.255 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.0 ttmm -52.61 -52.78 53.82 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.43 0.692 . . . . 0.0 110.734 -174.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 11.4 pttp -65.71 -43.68 88.38 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.359 1.064 . . . . 0.0 113.36 176.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -60.72 -50.47 73.34 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.808 1.185 . . . . 0.0 111.834 178.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.76 -51.5 66.9 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.653 1.181 . . . . 0.0 111.905 177.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.5 mtmm -57.86 -33.6 68.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.46 -50.15 34.44 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.037 0.835 . . . . 0.0 111.444 179.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 tttm -57.15 -49.73 75.02 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.654 0.782 . . . . 0.0 110.396 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -62.19 -52.0 65.53 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.72 1.208 . . . . 0.0 112.23 179.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.66 -46.27 90.47 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.803 1.183 . . . . 0.0 112.859 178.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -61.75 -50.16 73.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.527 1.131 . . . . 0.0 111.398 178.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tt -56.7 -51.16 69.86 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.467 1.107 . . . . 0.0 110.685 174.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.38 -40.86 97.85 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.982 -178.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.1 tttt -59.01 -50.86 72.5 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.384 0.993 . . . . 0.0 111.379 173.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.33 -44.87 86.43 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.268 0.556 . . . . 0.0 111.548 -176.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -60.53 -49.36 77.86 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.798 1.239 . . . . 0.0 110.94 175.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.03 -43.21 86.65 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.647 1.112 . . . . 0.0 112.843 175.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -55.14 -52.57 62.86 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.43 1.092 . . . . 0.0 112.445 173.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.51 -31.27 71.89 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 175.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.4 t -73.05 -23.76 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 125.678 1.591 . . . . 0.0 113.382 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.63 -30.77 67.54 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.695 1.369 . . . . 0.0 114.695 177.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.2 ptmt -86.09 -2.65 58.52 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.516 1.526 . . . . 0.0 114.219 172.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.9 tpp -96.86 -160.41 0.8 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.407 1.883 . . . . 0.0 111.833 -174.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -57.89 156.64 18.14 Favored Pre-proline 0 N--CA 1.478 0.971 0 C-N-CA 126.735 2.014 . . . . 0.0 113.984 174.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.79 -48.32 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 123.599 2.866 . . . . 0.0 112.858 -176.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -57.13 -32.96 66.89 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.034 1.334 . . . . 0.0 112.269 177.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.22 -48.79 74.49 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.474 0.709 . . . . 0.0 110.596 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -54.87 -45.5 74.62 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.713 0.688 . . . . 0.0 111.235 173.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? -54.99 -54.91 36.86 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 118.867 0.758 . . . . 0.0 111.241 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.54 -51.93 67.74 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.956 0.903 . . . . 0.0 113.15 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.4 -40.5 95.93 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -178.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.19 -45.11 94.84 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.481 0.712 . . . . 0.0 110.93 174.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -43.88 90.67 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.399 0.545 . . . . 0.0 112.374 172.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.63 -36.96 84.5 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 174.439 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 10.3 t -70.67 -42.41 70.77 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.406 1.082 . . . . 0.0 112.987 -178.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -70.5 -44.01 68.51 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.521 -0.737 . . . . 0.0 111.133 175.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.8 tt -68.26 -30.63 48.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 118.697 0.681 . . . . 0.0 112.371 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.06 -33.69 69.31 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 176.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -92.21 -28.29 17.12 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.087 0.955 . . . . 0.0 113.412 173.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -138.36 78.79 1.7 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.873 1.269 . . . . 0.0 112.501 -175.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -71.13 -11.12 60.77 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 70.1 m -83.26 -2.82 56.57 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.94 1.696 . . . . 0.0 114.502 175.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 97.5 mt -112.21 84.19 1.93 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.432 1.493 . . . . 0.0 111.826 -178.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -95.23 169.76 9.86 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.989 1.315 . . . . 0.0 112.616 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 123.21 -47.28 1.03 Allowed Glycine 0 N--CA 1.474 1.18 0 C-N-CA 127.143 2.306 . . . . 0.0 112.944 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.535 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.3 OUTLIER -60.66 -25.67 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 CA-C-N 117.889 0.844 . . . . 0.0 112.506 179.384 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -44.94 -38.45 4.69 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.761 1.224 . . . . 0.0 112.994 172.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.0 mtpt -63.99 -59.38 4.56 Favored 'General case' 0 C--N 1.345 0.394 0 C-N-CA 123.571 0.748 . . . . 0.0 111.031 174.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.535 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -63.16 -33.32 75.22 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.994 0.816 . . . . 0.0 113.071 -178.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.74 -53.73 53.04 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.688 1.595 . . . . 0.0 110.805 168.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -58.12 -48.12 81.19 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.044 0.937 . . . . 0.0 112.527 175.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 26.9 mm -54.05 -52.05 40.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.666 0.786 . . . . 0.0 110.562 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -66.62 -40.97 89.01 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 118.688 -0.672 . . . . 0.0 112.392 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.82 -40.36 94.99 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.566 1.075 . . . . 0.0 111.122 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 53.3 mt -75.86 -51.76 19.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 C-N-CA 123.983 0.913 . . . . 0.0 110.978 176.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -54.46 -46.44 73.34 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 118.879 0.763 . . . . 0.0 112.726 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 15.8 mmtp -65.61 -22.53 66.68 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.811 1.244 . . . . 0.0 112.424 176.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 93.7 m -86.69 -38.11 17.32 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.082 1.353 . . . . 0.0 112.929 177.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 31.9 mt -54.95 153.61 11.26 Favored Pre-proline 0 CA--C 1.553 1.09 0 C-N-CA 124.901 1.28 . . . . 0.0 113.146 176.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.65 158.83 55.72 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.951 2.434 . . . . 0.0 113.01 -176.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.04 -24.49 67.73 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.242 -0.911 . . . . 0.0 112.784 178.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.5 m -60.94 -51.54 68.85 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.248 0.931 . . . . 0.0 112.145 173.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 9.9 p -73.57 -37.34 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-N 118.529 0.604 . . . . 0.0 111.573 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.2 mtmp? -58.01 -49.89 75.31 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.794 -0.622 . . . . 0.0 111.972 172.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -64.33 -45.08 89.42 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.091 0.86 . . . . 0.0 112.891 177.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -65.63 -32.03 73.38 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.692 0.678 . . . . 0.0 112.744 -179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.19 -21.57 21.07 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 178.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -53.86 -38.22 64.46 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.875 1.27 . . . . 0.0 112.521 179.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 5.4 ttpt -72.07 -21.7 61.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.128 1.371 . . . . 0.0 113.761 177.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 60.46 -166.79 11.0 Favored Glycine 0 CA--C 1.539 1.591 0 C-N-CA 124.949 1.261 . . . . 0.0 114.391 -174.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -130.91 63.27 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 126.598 1.959 . . . . 0.0 110.947 -173.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 50.53 74.8 0.25 Allowed Glycine 0 CA--C 1.54 1.62 0 C-N-CA 126.473 1.987 . . . . 0.0 113.464 -175.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.03 128.56 17.88 Favored 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.364 2.71 . . . . 0.0 111.755 -175.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . 47.69 80.58 0.05 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.388 2.275 . . . . 0.0 114.197 -176.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 9.3 p -62.16 132.3 93.81 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.212 1.405 . . . . 0.0 111.278 178.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -74.35 174.69 12.09 Favored 'Trans proline' 0 CA--C 1.546 1.109 0 C-N-CA 122.676 2.251 . . . . 0.0 112.888 176.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 . . . . . 0 C--O 1.253 1.255 0 C-N-CA 125.967 1.707 . . . . 0.0 113.06 171.963 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 . . . . . 0 CA--C 1.539 0.528 0 CA-C-O 120.734 0.302 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -150.17 87.34 1.46 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 122.529 1.157 . . . . 0.0 110.246 177.003 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.11 158.15 80.25 Favored Pre-proline 0 CA--C 1.54 0.589 0 C-N-CA 123.827 0.851 . . . . 0.0 112.101 176.367 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -68.18 170.71 13.98 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 123.364 2.71 . . . . 0.0 112.482 177.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -64.82 115.65 3.37 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 122.686 2.257 . . . . 0.0 111.663 173.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -71.65 -19.78 27.51 Favored 'Trans proline' 0 CA--C 1.554 1.486 0 C-N-CA 122.099 1.866 . . . . 0.0 116.11 164.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.48 169.43 20.93 Favored 'Trans proline' 0 C--N 1.362 1.281 0 CA-C-N 124.272 2.561 . . . . 0.0 112.729 177.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -60.1 122.31 11.18 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.858 2.372 . . . . 0.0 110.75 171.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -53.4 -32.62 50.38 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.054 0.542 . . . . 0.0 111.949 172.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.561 ' H ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -103.12 38.9 1.66 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 128.312 2.645 . . . . 0.0 113.138 176.859 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.72 112.92 0.48 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.808 1.243 . . . . 0.0 113.296 176.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.5 11.06 0.32 Allowed Glycine 0 CA--C 1.538 1.474 0 C-N-CA 125.296 1.427 . . . . 0.0 115.634 -176.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -111.27 159.8 31.55 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 125.645 1.578 . . . . 0.0 112.846 -171.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -73.53 169.74 21.6 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 123.298 2.665 . . . . 0.0 113.085 178.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -52.53 -35.19 52.83 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.553 1.141 . . . . 0.0 113.659 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -56.38 -39.07 72.34 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.205 1.402 . . . . 0.0 112.802 174.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.404 HG13 ' HH2' ' A' ' 43' ' ' TRP . 54.5 t -77.91 -44.83 28.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 124.595 1.158 . . . . 0.0 111.792 171.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 94.2 t -54.22 -37.53 36.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 123.366 0.667 . . . . 0.0 111.468 -178.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.7 tppt? -59.91 -50.57 73.25 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 121.363 -0.836 . . . . 0.0 112.376 174.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.95 -47.97 83.17 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.044 0.938 . . . . 0.0 111.728 177.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.464 ' CD1' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -53.79 -53.67 49.11 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.665 0.786 . . . . 0.0 111.433 172.609 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -63.19 -45.1 93.31 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.445 1.02 . . . . 0.0 113.138 -179.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -59.74 -39.17 83.88 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.231 1.013 . . . . 0.0 111.555 177.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.492 HD23 HD22 ' A' ' 40' ' ' LEU . 12.9 tp -68.31 -45.8 71.99 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.148 0.579 . . . . 0.0 111.577 172.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.548 HD12 HD21 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -64.2 -45.73 87.0 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 179.759 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -56.88 -31.62 65.03 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 119.649 1.113 . . . . 0.0 112.431 178.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -73.65 -29.34 62.27 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.025 1.33 . . . . 0.0 111.744 175.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -109.81 23.7 14.03 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.045 1.738 . . . . 0.0 112.549 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -22.09 66.57 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 119.904 -1.747 . . . . 0.0 113.687 -175.502 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.0 p -92.88 4.11 54.48 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 128.803 2.841 . . . . 0.0 114.307 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -85.75 179.9 6.97 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.329 1.452 . . . . 0.0 111.858 178.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.22 171.27 7.71 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.284 2.234 . . . . 0.0 111.562 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -52.13 -57.62 14.51 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 124.625 1.17 . . . . 0.0 112.338 176.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.9 -33.19 27.16 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 121.516 1.477 . . . . 0.0 113.319 178.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.23 -47.14 80.83 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.166 -0.959 . . . . 0.0 112.603 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.4 mt -68.44 -53.28 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.089 0.556 . . . . 0.0 109.651 175.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -56.93 -35.84 69.52 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 119.023 -0.513 . . . . 0.0 112.068 -175.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 34.7 tttt -56.97 -58.32 8.66 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.194 1.798 . . . . 0.0 113.434 172.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -59.06 -40.06 84.0 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 122.962 0.505 . . . . 0.0 111.084 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.803 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.1 mm? -60.26 -50.33 74.08 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.369 1.068 . . . . 0.0 111.253 173.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.56 -33.25 71.19 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -58.62 -51.86 68.14 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.603 -0.686 . . . . 0.0 112.213 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.803 ' HE1' HD13 ' A' ' 40' ' ' LEU . 13.4 p-90 -73.8 -30.77 62.92 Favored 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 172.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.452 ' CG2' HD12 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -60.11 -32.15 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 O-C-N 120.781 -1.2 . . . . 0.0 112.677 174.427 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -58.0 -19.24 29.46 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 118.565 0.62 . . . . 0.0 112.268 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.89 -14.89 21.49 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.878 1.271 . . . . 0.0 113.222 177.273 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.643 HD11 ' CH2' ' A' ' 43' ' ' TRP . 22.8 mt -62.27 -65.94 0.61 Allowed 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 118.99 0.814 . . . . 0.0 112.528 175.551 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.32 104.59 0.67 Allowed Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.015 0.817 . . . . 0.0 111.807 -177.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 163.28 -163.29 35.45 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 125.181 1.372 . . . . 0.0 111.495 -176.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -57.58 -18.24 18.54 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.99 1.316 . . . . 0.0 113.439 -178.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -55.55 -21.65 18.06 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.072 2.149 . . . . 0.0 113.973 171.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.0 ptmt -55.05 -35.07 64.11 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.575 1.55 . . . . 0.0 113.613 171.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.81 -40.67 92.1 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.833 0.853 . . . . 0.0 111.27 174.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.17 -42.32 94.71 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 117.612 -1.185 . . . . 0.0 111.887 170.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -58.43 -52.85 63.89 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 120.406 1.457 . . . . 0.0 112.9 174.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -60.75 -42.11 96.76 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.811 -0.556 . . . . 0.0 111.621 -178.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.19 -34.83 63.88 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.816 0.846 . . . . 0.0 112.584 -179.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -57.35 -52.76 64.07 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 125.298 1.439 . . . . 0.0 111.095 172.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.35 -44.55 65.27 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.269 0.356 . . . . 0.0 110.786 -176.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 24.1 mmtt -61.68 -57.16 13.07 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.106 1.762 . . . . 0.0 114.277 171.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -55.37 -50.24 70.22 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.422 1.089 . . . . 0.0 112.376 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -63.98 -51.9 62.15 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 124.183 0.993 . . . . 0.0 112.298 178.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -52.83 -39.12 62.2 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 119.123 -0.465 . . . . 0.0 111.329 173.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.08 -51.42 54.67 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.023 0.829 . . . . 0.0 111.885 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.4 mttm -58.87 -51.67 69.01 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.013 0.925 . . . . 0.0 111.272 175.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -58.22 -52.63 64.78 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.809 1.244 . . . . 0.0 111.963 177.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.83 -52.75 63.87 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.827 1.194 . . . . 0.0 112.863 178.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -62.85 -48.99 76.64 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.323 0.649 . . . . 0.0 112.314 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tp -54.84 -49.66 70.52 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.964 1.306 . . . . 0.0 111.171 174.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.22 -43.6 98.62 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.515 1.126 . . . . 0.0 111.729 178.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -58.25 -50.76 72.42 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.588 1.085 . . . . 0.0 111.954 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.96 -48.5 78.63 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.539 1.136 . . . . 0.0 112.633 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -57.3 -54.24 49.08 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.879 0.872 . . . . 0.0 110.979 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -40.99 72.87 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.998 1.319 . . . . 0.0 113.041 177.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.02 -52.63 64.71 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.479 0.712 . . . . 0.0 112.424 172.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.04 -31.49 72.05 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 176.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 62.8 t -73.04 -23.84 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 126.016 1.726 . . . . 0.0 112.63 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.78 -32.66 63.66 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.684 -1.26 . . . . 0.0 114.159 176.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.7 pttt -87.92 0.45 55.85 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.527 1.531 . . . . 0.0 114.551 174.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 15.3 mmt -94.57 -159.82 0.73 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.734 1.614 . . . . 0.0 111.254 -178.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.8 156.43 6.66 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.209 2.203 . . . . 0.0 114.038 173.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -69.38 -45.49 1.77 Allowed 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 123.692 2.928 . . . . 0.0 112.726 -176.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -59.67 -31.32 69.44 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.143 0.977 . . . . 0.0 112.223 176.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -66.03 -49.23 68.46 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.191 0.596 . . . . 0.0 110.283 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.02 -46.88 61.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.891 0.877 . . . . 0.0 110.714 172.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -58.93 -54.91 41.85 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.734 0.814 . . . . 0.0 111.162 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.69 -47.84 84.47 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.541 0.736 . . . . 0.0 112.75 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.85 -40.05 83.73 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.08 -45.74 92.19 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 119.455 1.025 . . . . 0.0 110.742 174.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.62 -44.05 89.86 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.117 0.967 . . . . 0.0 112.219 173.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.8 tp -63.96 -36.66 84.71 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 121.576 -0.703 . . . . 0.0 112.539 171.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 7.7 t -72.28 -39.35 68.39 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 120.357 -1.464 . . . . 0.0 112.899 -178.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -71.16 -43.51 67.36 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.732 0.813 . . . . 0.0 110.989 175.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 7.3 tt -70.17 -32.13 49.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 118.588 0.631 . . . . 0.0 112.446 178.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.18 -30.21 64.32 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -92.46 0.78 57.47 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.256 1.422 . . . . 0.0 114.526 177.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -138.1 106.92 5.93 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.655 1.582 . . . . 0.0 113.411 -173.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -81.53 -22.74 37.7 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 178.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -84.42 -2.23 56.86 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.703 1.601 . . . . 0.0 114.284 176.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 16.0 mt -77.5 167.2 22.04 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 122.239 1.019 . . . . 0.0 113.37 172.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -80.02 165.29 22.71 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.708 1.603 . . . . 0.0 112.281 171.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -82.04 60.84 4.75 Favored Glycine 0 N--CA 1.468 0.797 0 C-N-CA 125.924 1.726 . . . . 0.0 113.034 178.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.36 -30.04 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.985 0.914 . . . . 0.0 112.172 179.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.07 -38.98 8.63 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.688 1.595 . . . . 0.0 113.101 177.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.78 -59.5 5.33 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.314 173.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -63.74 -33.69 76.22 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.735 0.698 . . . . 0.0 111.7 -176.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -60.14 -47.91 83.93 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.288 1.035 . . . . 0.0 111.817 173.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -46.35 91.08 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 118.403 -0.808 . . . . 0.0 111.665 174.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 24.9 mm -53.19 -49.81 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 125.123 1.369 . . . . 0.0 111.194 174.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -63.31 -44.17 95.71 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.98 1.264 . . . . 0.0 112.603 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.24 -49.03 79.23 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 122.707 0.403 . . . . 0.0 111.151 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.4 pp -70.99 -31.98 46.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 118.289 -0.863 . . . . 0.0 112.497 174.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -60.47 -42.78 96.91 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 120.345 1.43 . . . . 0.0 111.904 178.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -75.58 -11.72 60.07 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 174.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 33.2 p -130.72 48.9 2.37 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.382 1.473 . . . . 0.0 112.795 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.498 HD23 ' CG1' ' A' ' 120' ' ' VAL . 0.9 OUTLIER -54.0 149.88 16.61 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 123.898 0.879 . . . . 0.0 111.407 179.713 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.35 150.74 84.39 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.308 2.005 . . . . 0.0 111.684 -177.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -62.79 -22.5 66.66 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 176.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.9 m -62.61 -51.64 66.52 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.911 1.232 . . . . 0.0 112.256 174.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.498 ' CG1' HD23 ' A' ' 116' ' ' LEU . 9.4 p -73.6 -38.81 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 O-C-N 121.755 -0.591 . . . . 0.0 111.163 178.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 29.6 mmtt -58.31 -49.29 77.69 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.53 -0.731 . . . . 0.0 111.922 174.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -66.68 -43.56 84.14 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.445 1.02 . . . . 0.0 113.024 177.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -64.98 -36.74 85.39 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.368 -0.832 . . . . 0.0 112.429 179.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.67 -22.03 26.34 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.288 1.035 . . . . 0.0 113.128 179.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -52.91 -34.07 53.45 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.703 1.601 . . . . 0.0 112.132 179.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -80.49 -38.11 30.47 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.908 1.283 . . . . 0.0 113.547 175.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 143.96 179.08 20.22 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.781 1.657 . . . . 0.0 114.078 -179.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.88 66.86 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 126.251 1.82 . . . . 0.0 111.74 -173.048 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 47.5 74.79 0.22 Allowed Glycine 0 CA--C 1.543 1.787 0 C-N-CA 126.09 1.805 . . . . 0.0 113.789 -175.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -68.95 128.69 17.17 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.527 2.818 . . . . 0.0 112.008 -174.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -158.92 109.96 2.08 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.918 1.687 . . . . 0.0 110.197 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 5.5 p -95.24 137.27 22.16 Favored Pre-proline 0 N--CA 1.474 0.74 0 C-N-CA 124.238 1.015 . . . . 0.0 110.514 174.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -73.42 -10.5 23.96 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.771 2.314 . . . . 0.0 114.687 176.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.171 0 C-N-CA 125.264 1.426 . . . . 0.0 113.723 -177.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.55 0.951 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -91.81 0.75 57.47 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.249 1.419 . . . . 0.0 113.489 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.6 p -101.52 162.93 18.92 Favored Pre-proline 0 N--CA 1.475 0.822 0 C-N-CA 127.125 2.17 . . . . 0.0 112.825 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -70.59 170.05 18.5 Favored 'Trans proline' 0 CA--C 1.544 0.99 0 C-N-CA 123.481 2.787 . . . . 0.0 112.223 176.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -66.64 116.67 4.22 Favored 'Trans proline' 0 CA--C 1.547 1.125 0 C-N-CA 123.145 2.564 . . . . 0.0 111.88 172.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -71.23 -23.58 24.22 Favored 'Trans proline' 0 CA--C 1.554 1.476 0 C-N-CA 122.32 2.013 . . . . 0.0 116.888 167.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -71.97 168.91 22.62 Favored 'Trans proline' 0 C--N 1.361 1.232 0 CA-C-N 124.26 2.557 . . . . 0.0 113.156 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -61.93 130.08 29.72 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.831 2.354 . . . . 0.0 110.988 173.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -55.04 -42.53 72.77 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.922 0.868 . . . . 0.0 111.632 174.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.545 HD23 ' H ' ' A' ' 10' ' ' LEU . 2.2 pt? -78.73 17.02 0.75 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 127.991 2.516 . . . . 0.0 115.363 177.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -33.25 103.61 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 127.24 2.216 . . . . 0.0 115.325 -173.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.45 32.87 0.11 Allowed Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.095 1.331 . . . . 0.0 114.548 -172.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -125.23 157.79 66.12 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 125.621 1.568 . . . . 0.0 112.021 -175.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -74.44 169.08 23.32 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.065 2.51 . . . . 0.0 113.053 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -53.55 -37.29 62.74 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.65 1.18 . . . . 0.0 113.465 -177.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -57.27 -37.68 72.74 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.278 1.431 . . . . 0.0 112.671 176.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 65.0 t -82.65 -38.2 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.401 1.481 . . . . 0.0 112.194 174.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.1 t -57.56 -39.33 68.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.936 0.894 . . . . 0.0 110.742 177.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.5 tptm -61.13 -50.58 72.61 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.653 -1.28 . . . . 0.0 111.799 173.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -53.83 -47.27 71.09 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.237 0.615 . . . . 0.0 112.268 176.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -51.9 -52.97 46.11 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.388 1.075 . . . . 0.0 112.081 169.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -47.47 85.77 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.953 0.901 . . . . 0.0 113.331 -177.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.81 -38.89 92.79 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.422 0.689 . . . . 0.0 111.529 177.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 14.0 tp -63.71 -44.49 93.49 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 122.938 0.495 . . . . 0.0 111.969 172.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.58 -34.88 78.79 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.887 1.275 . . . . 0.0 113.871 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.9 mmtt -54.66 -32.95 59.97 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.844 1.202 . . . . 0.0 113.991 174.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.9 ttpp -69.1 -38.56 79.0 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.88 1.272 . . . . 0.0 112.715 172.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -104.17 14.35 30.6 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.709 1.604 . . . . 0.0 113.245 -172.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -22.3 41.58 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 120.33 -1.481 . . . . 0.0 114.694 -175.161 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.7 p -103.67 1.16 31.56 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 127.123 2.169 . . . . 0.0 114.847 179.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -76.81 170.65 16.08 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.39 1.476 . . . . 0.0 111.96 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.29 171.76 12.42 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.888 1.675 . . . . 0.0 111.915 175.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -50.97 -59.72 6.99 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 124.75 1.22 . . . . 0.0 112.218 174.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.547 ' HA ' ' HG3' ' A' ' 37' ' ' GLU . 59.2 Cg_endo -67.03 -28.86 41.11 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.296 1.997 . . . . 0.0 113.479 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -67.53 -50.05 60.51 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.064 -1.648 . . . . 0.0 112.586 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 91.7 mt -62.97 -53.4 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 CA-C-N 118.662 0.665 . . . . 0.0 110.022 176.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.547 ' HG3' ' HA ' ' A' ' 34' ' ' PRO . 2.0 pp20? -55.33 -42.33 73.65 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 117.866 -1.064 . . . . 0.0 111.244 -177.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -57.56 -51.39 69.69 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-N 119.672 1.124 . . . . 0.0 112.066 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -40.74 96.63 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.725 HD13 ' HE1' ' A' ' 43' ' ' TRP . 3.2 mm? -61.13 -51.12 70.41 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.687 0.795 . . . . 0.0 111.789 172.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.85 -30.45 71.51 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.149 -0.97 . . . . 0.0 113.106 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.16 -49.05 78.8 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.129 -0.982 . . . . 0.0 112.346 178.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.725 ' HE1' HD13 ' A' ' 40' ' ' LEU . 10.8 p-90 -73.72 -35.52 65.11 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 173.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.618 HG23 HD12 ' A' ' 47' ' ' LEU . 0.4 OUTLIER -59.65 -30.68 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 124.898 1.279 . . . . 0.0 112.401 176.813 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -57.27 -14.51 4.48 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.909 0.884 . . . . 0.0 112.912 174.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.79 -12.11 16.0 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.645 1.578 . . . . 0.0 113.833 176.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.678 HD11 ' CH2' ' A' ' 43' ' ' TRP . 17.5 mt -67.67 -54.38 20.07 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 176.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -154.2 -153.08 6.3 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 125.441 1.496 . . . . 0.0 111.224 -169.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -131.42 13.57 5.4 Favored Glycine 0 CA--C 1.528 0.899 0 N-CA-C 116.49 1.356 . . . . 0.0 116.49 -172.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -112.04 -35.1 5.77 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.396 1.479 . . . . 0.0 111.988 175.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -76.21 -26.83 56.5 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.18 0.592 . . . . 0.0 111.974 -178.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -53.84 -35.04 61.05 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.613 1.565 . . . . 0.0 114.126 172.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.06 -50.71 67.32 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.221 0.608 . . . . 0.0 110.342 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -48.96 -46.34 43.28 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 117.525 -1.226 . . . . 0.0 111.864 170.095 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -55.55 -48.05 75.37 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 119.869 1.213 . . . . 0.0 112.981 174.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -58.05 -46.44 85.39 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.456 1.025 . . . . 0.0 112.246 178.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.7 -41.62 83.3 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.744 1.218 . . . . 0.0 114.078 178.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -72.79 -43.29 62.97 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 121.214 -0.929 . . . . 0.0 113.075 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -53.17 -51.02 63.38 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.873 0.869 . . . . 0.0 111.253 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.1 pttp -63.46 -43.23 97.96 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 118.5 -0.762 . . . . 0.0 112.355 175.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -57.53 -47.41 82.08 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 119.639 1.109 . . . . 0.0 112.635 173.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -61.08 -53.5 56.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.829 1.252 . . . . 0.0 111.989 178.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.9 mtmt -60.14 -31.89 70.51 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 119.032 -0.509 . . . . 0.0 112.344 175.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.43 -51.47 23.74 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.837 0.744 . . . . 0.0 111.455 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -58.76 -49.29 78.19 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.744 0.817 . . . . 0.0 110.791 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -60.96 -52.27 65.75 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.773 1.229 . . . . 0.0 112.131 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.8 -44.7 96.35 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 119.797 1.18 . . . . 0.0 113.258 179.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -67.53 -45.08 76.77 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.456 0.703 . . . . 0.0 111.954 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.01 -51.23 70.1 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.119 0.967 . . . . 0.0 110.949 170.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.4 -42.93 99.52 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.716 -0.659 . . . . 0.0 112.057 -179.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -56.31 -50.76 70.53 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.558 1.072 . . . . 0.0 111.965 173.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.55 82.05 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -60.65 -49.44 77.51 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.049 0.94 . . . . 0.0 111.046 176.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.63 -42.64 83.79 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.086 1.354 . . . . 0.0 112.993 175.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -56.25 -52.59 63.91 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.324 1.05 . . . . 0.0 112.171 172.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.88 -31.52 72.17 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 177.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.1 t -73.06 -24.8 21.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 125.812 1.645 . . . . 0.0 113.086 176.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.65 -30.59 65.54 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 177.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.2 1.28 54.8 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.729 1.611 . . . . 0.0 114.406 172.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 6.3 ttm -103.53 -158.57 0.67 Allowed 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 126.429 1.891 . . . . 0.0 111.558 -172.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.76 156.11 36.65 Favored Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 125.179 1.391 . . . . 0.0 113.958 178.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -71.65 -43.86 1.21 Allowed 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 123.44 2.76 . . . . 0.0 113.084 -176.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -58.97 -34.3 71.65 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.329 1.052 . . . . 0.0 112.107 175.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.72 -43.59 88.61 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 122.998 0.519 . . . . 0.0 110.241 177.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -42.82 77.26 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.219 1.008 . . . . 0.0 112.056 173.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -59.83 -54.29 47.99 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.466 1.107 . . . . 0.0 111.563 175.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.43 -51.52 69.53 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.232 1.013 . . . . 0.0 113.085 178.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.6 -34.83 76.45 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 179.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.35 -51.67 68.95 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.46 1.027 . . . . 0.0 109.92 172.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -52.93 -51.96 59.5 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.808 0.843 . . . . 0.0 111.947 173.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.27 -37.86 84.65 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.7 t -72.98 -37.72 66.92 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.282 1.033 . . . . 0.0 112.541 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -38.86 56.73 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 121.706 -0.621 . . . . 0.0 111.694 177.35 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 12.0 tt -70.71 -31.62 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 119.148 0.886 . . . . 0.0 112.778 175.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.11 -33.38 67.28 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -88.25 -28.28 21.22 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.147 0.979 . . . . 0.0 113.559 171.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -126.58 88.08 2.77 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.025 1.73 . . . . 0.0 112.465 -172.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.89 -8.41 15.34 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 176.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.2 t -66.38 -17.12 64.59 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.232 1.413 . . . . 0.0 114.428 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 5.6 mt -82.58 84.26 7.31 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.008 1.723 . . . . 0.0 110.945 -178.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -88.82 154.53 20.19 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.285 1.034 . . . . 0.0 111.61 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 66.89 7.46 42.94 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.771 1.177 . . . . 0.0 115.761 -178.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -61.22 -28.47 43.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 118.75 1.275 . . . . 0.0 112.911 -170.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -48.52 -38.93 21.58 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.411 1.085 . . . . 0.0 113.36 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -59.3 -59.35 5.6 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.845 0.858 . . . . 0.0 111.626 174.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -65.89 -33.38 75.69 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -177.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.59 -51.02 71.68 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.645 1.178 . . . . 0.0 110.53 171.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -52.75 -51.88 58.78 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 117.715 -1.136 . . . . 0.0 111.095 172.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 10.4 mm -53.68 -48.5 60.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.284 0.947 . . . . 0.0 111.582 177.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -65.08 -44.11 89.99 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.31 -0.869 . . . . 0.0 113.209 178.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.08 78.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.951 0.9 . . . . 0.0 112.126 177.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.49 -37.15 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 122.853 0.461 . . . . 0.0 111.891 175.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -58.42 -44.12 88.97 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 119.458 1.026 . . . . 0.0 112.194 176.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 8.1 mmtt -67.41 -15.7 63.82 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.554 1.142 . . . . 0.0 113.475 176.134 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 59.2 p -106.09 3.14 27.78 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.58 1.152 . . . . 0.0 113.961 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 51.4 mt -65.34 157.48 77.51 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 124.762 1.225 . . . . 0.0 113.393 177.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -71.67 161.86 43.9 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 123.414 2.743 . . . . 0.0 112.932 177.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -63.98 -24.89 67.89 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.547 -0.721 . . . . 0.0 112.865 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.9 t -61.22 -51.64 68.14 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.229 -0.919 . . . . 0.0 111.981 177.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 7.1 p -73.97 -38.12 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 121.737 -0.602 . . . . 0.0 112.051 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.47 -48.84 76.26 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.073 0.851 . . . . 0.0 111.706 171.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -67.93 -42.5 80.94 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.306 0.957 . . . . 0.0 112.96 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -65.99 -34.25 77.67 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.137 0.881 . . . . 0.0 112.592 177.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.08 -22.82 25.18 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 178.361 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -55.07 -31.13 60.93 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.511 1.525 . . . . 0.0 113.011 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 15.1 tttt -59.07 -31.56 68.98 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.246 1.018 . . . . 0.0 112.58 173.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 70.14 38.76 72.93 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 125.072 1.32 . . . . 0.0 114.705 176.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER 37.44 52.51 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 C-N-CA 128.059 2.544 . . . . 0.0 114.222 178.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 61.1 74.81 0.34 Allowed Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.64 1.59 . . . . 0.0 112.342 -174.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -73.79 -29.09 10.84 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.614 2.876 . . . . 0.0 112.584 -170.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -160.0 114.08 2.24 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 127.227 2.211 . . . . 0.0 109.349 172.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 41.0 t -95.46 130.71 31.36 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 124.699 1.2 . . . . 0.0 109.613 176.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -70.13 174.28 10.06 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 123.549 2.833 . . . . 0.0 112.775 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.212 0 C-N-CA 124.023 0.929 . . . . 0.0 113.267 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 34.3 t70 . . . . . 0 N--CA 1.472 0.633 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.7 -153.38 0.2 Allowed 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 125.585 1.554 . . . . 0.0 113.161 176.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.86 158.49 72.29 Favored Pre-proline 0 N--CA 1.478 0.961 0 C-N-CA 125.637 1.575 . . . . 0.0 111.721 171.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -68.12 167.68 21.2 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.47 2.78 . . . . 0.0 113.124 178.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -64.46 126.38 16.81 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 123.953 3.102 . . . . 0.0 111.633 175.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -67.64 -24.77 41.14 Favored 'Trans proline' 0 CA--C 1.554 1.497 0 C-N-CA 122.669 2.246 . . . . 0.0 116.492 167.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.6 166.36 26.16 Favored 'Trans proline' 0 C--N 1.361 1.223 0 CA-C-N 124.093 2.497 . . . . 0.0 112.8 175.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HA ' ' CE1' ' A' ' 21' ' ' PHE . 35.0 Cg_endo -59.15 131.3 40.54 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 123.099 2.533 . . . . 0.0 111.626 171.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -48.4 -47.22 37.87 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.415 0.686 . . . . 0.0 111.818 170.068 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.56 HD23 ' H ' ' A' ' 10' ' ' LEU . 1.8 pt? -83.47 18.06 1.96 Allowed 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 126.6 1.96 . . . . 0.0 115.219 -178.577 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -32.92 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 127.018 2.127 . . . . 0.0 115.611 -172.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 142.09 27.71 0.17 Allowed Glycine 0 CA--C 1.537 1.453 0 C-N-CA 124.814 1.197 . . . . 0.0 114.448 -172.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.79 157.45 59.84 Favored Pre-proline 0 CA--C 1.552 1.036 0 C-N-CA 125.722 1.609 . . . . 0.0 111.663 -175.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -73.36 168.37 24.94 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.114 2.543 . . . . 0.0 112.923 -178.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -54.76 -38.24 66.97 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.532 1.133 . . . . 0.0 113.464 -177.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.76 -40.9 66.61 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.517 1.527 . . . . 0.0 112.428 173.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 97.1 t -80.69 -39.52 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 C-N-CA 124.812 1.245 . . . . 0.0 111.683 176.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 59.5 t -56.28 -40.91 68.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.077 0.951 . . . . 0.0 111.105 177.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.7 tptm -61.28 -50.69 72.01 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 121.132 -0.98 . . . . 0.0 111.968 173.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -53.36 -47.58 69.29 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.531 0.733 . . . . 0.0 112.042 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.428 ' CE1' ' HA ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -52.06 -53.79 38.02 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.676 1.191 . . . . 0.0 112.156 169.742 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.33 -47.61 84.77 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.27 0.941 . . . . 0.0 113.533 -178.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -68.61 -28.76 67.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.477 0.711 . . . . 0.0 112.295 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.3 tp -68.75 -48.53 63.51 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 121.56 -0.713 . . . . 0.0 111.668 165.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.71 -34.65 73.18 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.652 1.581 . . . . 0.0 113.905 -178.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -30.72 47.42 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.924 1.238 . . . . 0.0 113.099 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.4 -34.33 70.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.882 1.673 . . . . 0.0 112.372 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -109.85 16.84 21.73 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.952 2.101 . . . . 0.0 113.15 -175.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -20.59 56.65 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 119.974 -1.704 . . . . 0.0 114.529 -174.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.1 m -102.24 0.77 34.95 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.849 2.06 . . . . 0.0 113.086 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -74.33 175.96 7.15 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.23 1.412 . . . . 0.0 111.875 176.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.65 174.7 6.86 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.4 1.88 . . . . 0.0 111.902 175.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.78 -60.69 3.84 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 126.539 1.935 . . . . 0.0 112.774 172.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.85 -33.77 25.88 Favored 'Trans proline' 0 C--N 1.357 1.014 0 C-N-CA 121.881 1.721 . . . . 0.0 113.284 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -65.06 -46.16 82.32 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.118 -0.989 . . . . 0.0 112.224 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 66.7 mt -67.73 -53.29 32.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 122.931 0.493 . . . . 0.0 110.371 175.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -56.38 -38.33 71.3 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 118.403 0.547 . . . . 0.0 111.835 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -58.19 -57.17 14.02 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 125.227 1.411 . . . . 0.0 113.016 173.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -65.8 -35.47 80.79 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.756 0.312 . . . . 0.0 111.672 -175.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.779 HD13 ' HE1' ' A' ' 43' ' ' TRP . 1.7 mm? -64.54 -49.46 71.16 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.977 1.311 . . . . 0.0 111.732 170.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.26 -41.0 71.61 Favored 'General case' 0 N--CA 1.465 0.319 0 O-C-N 121.177 -0.952 . . . . 0.0 113.303 174.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.64 -48.7 71.95 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -175.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.779 ' HE1' HD13 ' A' ' 40' ' ' LEU . 8.1 p-90 -72.92 -36.01 67.16 Favored 'General case' 0 CA--C 1.554 1.119 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 168.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -56.71 -32.85 39.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 125.258 1.423 . . . . 0.0 112.364 175.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -60.1 -15.63 25.04 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.827 0.851 . . . . 0.0 112.762 177.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 21.5 m -100.88 -17.99 16.58 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.414 1.486 . . . . 0.0 112.614 176.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.69 HD11 ' CH2' ' A' ' 43' ' ' TRP . 17.8 mt -63.73 -52.16 61.7 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 178.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -176.9 -166.75 34.4 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 123.73 0.681 . . . . 0.0 112.558 -165.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -122.95 12.69 8.61 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 125.603 1.573 . . . . 0.0 114.5 -175.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -106.05 -32.65 8.19 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.664 2.385 . . . . 0.0 112.46 173.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -71.95 -22.23 61.48 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 121.317 -0.864 . . . . 0.0 112.482 176.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.99 -34.31 59.46 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.373 1.469 . . . . 0.0 114.248 171.242 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.98 -38.61 82.92 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.625 0.77 . . . . 0.0 111.717 178.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.44 -44.89 92.83 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.425 -0.797 . . . . 0.0 111.551 169.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -57.57 -47.82 81.04 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.253 0.933 . . . . 0.0 113.054 173.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -43.97 90.76 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.646 0.657 . . . . 0.0 111.248 -179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.07 -37.5 66.77 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.011 0.524 . . . . 0.0 112.312 -178.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -63.64 -55.53 22.85 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 123.77 0.828 . . . . 0.0 111.43 174.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -54.5 -39.79 67.9 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 118.641 0.655 . . . . 0.0 111.871 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.1 mmtt -59.37 -57.22 13.96 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.925 1.29 . . . . 0.0 113.876 170.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -59.47 -41.87 90.74 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 118.57 0.623 . . . . 0.0 112.381 178.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -51.93 64.02 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 124.866 1.266 . . . . 0.0 112.502 177.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -55.68 -38.65 69.92 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.918 0.887 . . . . 0.0 111.038 172.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.64 -46.92 67.92 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 123.117 0.567 . . . . 0.0 111.884 -178.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -59.57 -53.26 60.16 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.249 1.02 . . . . 0.0 111.581 175.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.2 -38.27 89.94 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.71 -50.85 69.49 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.316 0.962 . . . . 0.0 112.409 175.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -65.98 -44.61 84.42 Favored 'General case' 0 C--O 1.245 0.816 0 C-N-CA 123.197 0.599 . . . . 0.0 112.037 -178.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 26.6 mt -59.13 -51.29 70.66 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 124.297 1.039 . . . . 0.0 111.788 173.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.13 -40.87 97.38 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.996 179.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.8 tttm -58.29 -51.11 71.17 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.098 1.317 . . . . 0.0 111.994 174.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.0 -48.77 78.83 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.27 0.628 . . . . 0.0 112.44 177.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -58.87 -50.04 75.51 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.306 1.042 . . . . 0.0 110.941 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.11 -41.72 84.19 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.332 1.453 . . . . 0.0 113.269 175.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -55.76 -52.58 63.45 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.55 1.14 . . . . 0.0 112.209 172.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.55 -31.84 72.19 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 54.1 t -73.26 -24.27 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 C-N-CA 125.512 1.525 . . . . 0.0 112.783 176.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.68 -34.62 65.2 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 176.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 17.9 pttt -84.4 0.18 50.43 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.297 1.439 . . . . 0.0 114.349 174.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.7 ttm -103.0 -159.64 0.74 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.947 2.099 . . . . 0.0 111.445 -173.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -58.72 154.78 34.19 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 125.339 1.456 . . . . 0.0 113.665 178.459 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -68.51 -45.73 2.34 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.573 2.849 . . . . 0.0 112.762 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -33.48 72.63 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.966 1.306 . . . . 0.0 112.893 176.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.97 -48.72 75.32 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 122.795 0.438 . . . . 0.0 110.218 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.2 -44.84 68.28 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.95 173.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -59.44 -55.44 34.58 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.522 1.055 . . . . 0.0 110.903 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.89 -51.49 69.38 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.242 0.617 . . . . 0.0 112.251 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.75 -39.25 93.83 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.5 -44.44 94.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 119.26 0.936 . . . . 0.0 111.104 174.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.55 -45.42 88.99 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.502 0.721 . . . . 0.0 112.782 172.07 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.422 ' HA ' HG22 ' A' ' 94' ' ' ILE . 7.8 mp -64.47 -34.77 78.97 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.888 0.767 . . . . 0.0 112.372 173.111 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 15.6 t -70.9 -45.12 64.88 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 120.686 -1.259 . . . . 0.0 112.903 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 ptpm? -66.47 -49.24 67.28 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.225 0.61 . . . . 0.0 109.987 175.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.422 HG22 ' HA ' ' A' ' 91' ' ' LEU . 9.1 tt -65.32 -32.39 58.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 118.958 0.799 . . . . 0.0 112.509 -176.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.34 -19.4 63.31 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 178.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -115.48 -22.99 9.02 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.461 0.911 . . . . 0.0 113.461 170.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -126.56 79.88 1.89 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.172 1.389 . . . . 0.0 108.888 -177.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -65.16 -31.77 73.12 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.817 1.247 . . . . 0.0 112.386 -178.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.6 m -73.09 -18.07 61.34 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 126.184 1.794 . . . . 0.0 114.53 177.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -77.73 84.16 4.07 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 124.834 1.253 . . . . 0.0 109.364 175.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -93.12 -170.29 2.37 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.172 1.789 . . . . 0.0 111.405 173.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 93.38 -59.09 2.28 Favored Glycine 0 N--CA 1.466 0.664 0 C-N-CA 124.949 1.262 . . . . 0.0 111.5 178.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.513 HD13 ' HB3' ' A' ' 106' ' ' ALA . 0.2 OUTLIER -56.43 -24.35 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 125.079 1.352 . . . . 0.0 113.466 -177.687 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -46.94 -32.49 3.88 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.217 1.407 . . . . 0.0 113.247 169.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -55.56 -60.09 3.91 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.119 0.967 . . . . 0.0 111.336 169.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.513 ' HB3' HD13 ' A' ' 103' ' ' ILE . . . -65.99 -34.05 77.22 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.212 -0.93 . . . . 0.0 112.332 -176.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.71 -54.58 42.56 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.866 0.866 . . . . 0.0 110.83 171.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -56.06 -52.49 64.08 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 118.375 -0.821 . . . . 0.0 112.062 174.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 6.9 mm -51.84 -49.19 37.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.208 1.403 . . . . 0.0 111.073 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -67.15 -43.77 81.48 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.683 1.129 . . . . 0.0 112.842 178.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.14 -49.19 78.82 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.83 0.852 . . . . 0.0 111.319 177.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 2.4 pp -68.76 -37.3 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 118.615 -0.707 . . . . 0.0 112.247 174.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -56.06 -41.05 74.49 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.744 1.218 . . . . 0.0 112.68 177.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -69.02 -18.11 64.0 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 176.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 6.4 t -117.45 22.05 12.67 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.971 1.309 . . . . 0.0 112.907 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 36.4 mt -59.72 151.67 61.54 Favored Pre-proline 0 CA--C 1.546 0.826 0 O-C-N 120.849 -1.157 . . . . 0.0 113.218 177.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -70.16 159.13 54.18 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.377 2.718 . . . . 0.0 112.548 -179.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.06 -23.95 66.8 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.912 176.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 61.3 m -68.72 -39.22 80.51 Favored 'General case' 0 C--N 1.352 0.677 0 CA-C-O 117.346 -1.312 . . . . 0.0 114.217 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 8.3 p -79.6 -37.82 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-N 119.098 0.863 . . . . 0.0 110.189 175.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -57.55 -48.26 79.8 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.126 0.875 . . . . 0.0 111.669 173.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -68.34 -43.01 78.45 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.086 0.857 . . . . 0.0 112.541 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -64.95 -32.87 74.8 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.251 -0.905 . . . . 0.0 112.859 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.406 HD12 ' C ' ' A' ' 124' ' ' LEU . 0.6 OUTLIER -90.86 -19.94 22.83 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.355 1.062 . . . . 0.0 113.418 179.618 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.9 -29.12 55.18 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 125.084 1.354 . . . . 0.0 112.815 178.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 12.6 tmtt? -65.13 -26.13 68.06 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.565 1.546 . . . . 0.0 113.502 174.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -161.38 91.41 0.11 Allowed Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.749 1.166 . . . . 0.0 114.207 -172.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.448 HD13 ' H ' ' A' ' 128' ' ' ILE . 0.1 OUTLIER -88.14 68.02 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 127.229 2.211 . . . . 0.0 112.546 -178.153 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 46.52 77.78 0.1 OUTLIER Glycine 0 CA--C 1.544 1.892 0 C-N-CA 126.834 2.159 . . . . 0.0 113.185 -177.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.02 101.88 1.27 Allowed 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 123.931 3.087 . . . . 0.0 112.689 -171.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -156.87 110.92 2.69 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.207 1.803 . . . . 0.0 111.267 179.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 12.6 p -70.11 132.87 88.01 Favored Pre-proline 0 N--CA 1.476 0.85 0 C-N-CA 124.823 1.249 . . . . 0.0 111.002 173.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -73.15 179.1 5.75 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 123.234 2.623 . . . . 0.0 112.516 176.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 C--O 1.253 1.247 0 C-N-CA 125.224 1.41 . . . . 0.0 113.359 176.002 . . . . . . . . 0 0 . 1 stop_ save_