data_1gnb_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 1gnb _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 89' ' ' GLU . . . . . . . . . . . . . 42.6 mp0 . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 42.0 mt -71.11 78.31 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 10.6 t -141.36 154.16 45.5 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.5 1.52 . . . . 0.0 107.916 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.41 -49.52 44.54 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -167.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -75.03 105.37 6.01 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 -176.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.42 -38.27 52.68 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.771 0.428 . . . . 0.0 111.518 172.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -81.64 1.5 33.72 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.116 0.966 . . . . 0.0 113.046 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 61.17 36.12 18.2 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.831 1.252 . . . . 0.0 112.75 173.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -71.32 63.03 0.36 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.977 1.711 . . . . 0.0 112.302 -172.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 62.02 55.56 27.39 Favored Glycine 0 CA--C 1.528 0.864 0 N-CA-C 109.886 -1.286 . . . . 0.0 109.886 -173.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 8.3 t . . . . . 0 C--O 1.27 2.172 0 CA-C-O 117.364 -1.303 . . . . 0.0 111.228 -174.135 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 . . . . . 0 CA--C 1.54 0.564 0 CA-C-O 120.92 0.391 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.5 mt -72.89 74.29 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.7 m -110.04 150.01 29.17 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 126.078 1.751 . . . . 0.0 109.238 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.78 -49.02 78.0 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 171.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -69.11 92.69 0.55 Allowed 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 166.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.17 -36.13 39.52 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.551 0.74 . . . . 0.0 111.79 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.84 18.02 8.31 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.993 0.917 . . . . 0.0 112.447 178.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.48 4.65 5.14 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.565 1.546 . . . . 0.0 113.723 170.406 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.37 70.85 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.852 2.461 . . . . 0.0 113.348 -173.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.85 32.59 7.89 Favored Glycine 0 CA--C 1.53 0.972 0 C-N-CA 124.591 1.091 . . . . 0.0 111.47 -177.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 35.4 t . . . . . 0 C--O 1.27 2.181 0 CA-C-O 116.422 -1.751 . . . . 0.0 109.371 167.846 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 25.2 mm -70.9 77.43 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-O 121.301 0.572 . . . . 0.0 110.755 -173.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 47.9 t -145.8 140.15 26.92 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 126.125 1.77 . . . . 0.0 106.921 168.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -81.0 49.73 1.28 Allowed 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -159.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -124.27 108.73 12.55 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 169.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.64 -38.54 64.18 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 117.986 0.357 . . . . 0.0 111.061 172.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.73 -12.98 60.75 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.09 0.956 . . . . 0.0 113.099 177.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.4 t 50.69 39.45 21.8 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.267 1.427 . . . . 0.0 112.892 173.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 91.7 m -140.7 125.7 18.35 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 -175.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 52.49 53.46 31.99 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 123.516 0.579 . . . . 0.0 111.885 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 47.8 t . . . . . 0 C--O 1.268 2.072 0 CA-C-O 116.989 -1.481 . . . . 0.0 111.125 -172.1 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 . . . . . 0 N--CA 1.451 -0.403 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 50.4 mt -72.67 77.07 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 173.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 38.4 t -160.84 159.25 29.63 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.461 1.104 . . . . 0.0 108.637 -164.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.79 -19.93 31.82 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -176.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -68.7 84.05 0.29 Allowed 'General case' 0 N--CA 1.454 -0.256 0 O-C-N 121.696 -0.628 . . . . 0.0 110.747 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.88 -26.67 6.12 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.527 1.131 . . . . 0.0 111.43 167.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.15 -18.41 3.75 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.894 1.277 . . . . 0.0 113.599 172.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 48.6 t 60.93 36.91 18.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.077 0.853 . . . . 0.0 110.567 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.8 m -172.44 153.97 3.06 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 127.34 2.256 . . . . 0.0 105.385 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.86 -6.05 83.06 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-O 118.648 -1.085 . . . . 0.0 114.952 164.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 45.5 t . . . . . 0 C--O 1.27 2.156 0 CA-C-N 119.215 1.507 . . . . 0.0 110.314 175.501 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.6 mp0 . . . . . 0 CA--C 1.539 0.553 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.5 mt -71.27 78.91 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 121.445 -0.784 . . . . 0.0 109.476 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.7 t -141.87 151.84 43.08 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 125.387 1.475 . . . . 0.0 108.445 171.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.22 -33.41 70.95 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.296 0.639 . . . . 0.0 112.131 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 14.4 m-30 -67.75 97.18 0.61 Allowed 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 122.05 -0.406 . . . . 0.0 110.54 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.64 -35.53 61.09 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.958 -0.464 . . . . 0.0 111.49 168.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -74.36 -10.12 59.27 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.11 0.964 . . . . 0.0 112.762 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER 61.28 46.15 8.11 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.861 1.664 . . . . 0.0 112.709 175.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.87 75.52 0.2 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.144 1.378 . . . . 0.0 110.59 -177.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.32 -56.64 4.07 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 37.2 t . . . . . 0 C--O 1.271 2.196 0 CA-C-O 116.91 -1.519 . . . . 0.0 109.072 175.531 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 CA--C 1.538 0.494 0 CA-C-O 121.097 0.475 . . . . 0.0 109.817 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.6 mp -70.63 82.77 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 43.6 t -129.65 153.65 47.9 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 126.091 1.756 . . . . 0.0 107.664 166.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.69 -43.58 26.67 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.713 0.805 . . . . 0.0 111.526 177.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -71.53 90.98 1.03 Allowed 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 173.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.69 -32.22 63.1 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.065 0.546 . . . . 0.0 111.321 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.91 -6.45 57.47 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.848 1.259 . . . . 0.0 112.799 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 76.26 -52.14 0.6 Allowed 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 126.656 1.982 . . . . 0.0 113.743 171.297 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.5 m -39.3 102.28 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.295 1.838 . . . . 0.0 112.752 -175.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 118.78 -31.71 5.43 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 124.326 0.965 . . . . 0.0 112.118 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 45.3 t . . . . . 0 C--O 1.27 2.15 0 CA-C-O 117.211 -1.376 . . . . 0.0 110.426 179.799 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 CA--C 1.537 0.468 0 CA-C-O 121.296 0.569 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 49.8 mt -69.82 79.27 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 123.32 0.648 . . . . 0.0 109.269 -178.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.8 t -139.52 152.84 47.25 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 125.797 1.639 . . . . 0.0 108.091 171.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.94 -35.11 68.7 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.314 0.646 . . . . 0.0 112.041 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -69.41 94.68 0.75 Allowed 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 121.995 -0.441 . . . . 0.0 110.57 -178.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.18 -39.07 59.57 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 122.002 -0.437 . . . . 0.0 110.763 167.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.49 -12.89 61.39 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.225 1.01 . . . . 0.0 113.052 176.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.5 t 64.32 45.04 4.01 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.599 1.56 . . . . 0.0 112.493 174.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.9 73.84 0.28 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.122 1.369 . . . . 0.0 110.464 -178.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.06 -57.75 3.97 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -177.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 39.9 t . . . . . 0 C--O 1.27 2.139 0 CA-C-O 117.239 -1.362 . . . . 0.0 109.148 176.753 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 . . . . . 0 CA--C 1.542 0.657 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 28.0 mm -72.42 76.71 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.242 -0.911 . . . . 0.0 109.719 -177.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 55.8 m -128.97 129.8 45.88 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.713 1.605 . . . . 0.0 108.452 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.94 -37.14 73.59 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.269 0.557 . . . . 0.0 110.039 170.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -67.2 85.3 0.15 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 171.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.99 -38.35 50.52 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.475 1.11 . . . . 0.0 111.645 176.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.37 -13.13 36.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.528 1.131 . . . . 0.0 113.199 177.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER 66.21 51.48 1.25 Allowed 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.655 1.182 . . . . 0.0 111.344 172.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 16.9 m -157.62 147.29 20.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 105.632 -1.988 . . . . 0.0 105.632 176.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.6 20.7 70.24 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-O 119.914 -0.381 . . . . 0.0 112.838 -177.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 41.2 t . . . . . 0 C--O 1.269 2.101 0 CA-C-O 117.25 -1.357 . . . . 0.0 110.343 178.987 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 . . . . . 0 CA--C 1.543 0.682 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.3 mt -74.03 75.17 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.103 -0.998 . . . . 0.0 108.995 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 50.8 m -134.32 124.83 26.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.573 1.549 . . . . 0.0 108.117 -178.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.81 -37.02 70.62 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.354 0.597 . . . . 0.0 110.145 171.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -67.32 84.44 0.15 Allowed 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 171.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.16 -31.36 63.31 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.099 0.96 . . . . 0.0 111.554 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.43 -16.91 57.77 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.915 0.886 . . . . 0.0 112.604 174.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 66.5 50.49 1.24 Allowed 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 125.118 1.367 . . . . 0.0 111.23 172.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 17.2 m -157.61 146.91 19.9 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 105.297 -2.112 . . . . 0.0 105.297 175.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.11 23.37 71.32 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-O 119.909 -0.384 . . . . 0.0 112.783 -177.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 44.5 t . . . . . 0 C--O 1.271 2.2 0 CA-C-O 117.274 -1.346 . . . . 0.0 110.185 177.717 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 38.9 mt -71.4 79.63 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 O-C-N 121.408 -0.808 . . . . 0.0 109.47 -176.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 88.8 m -129.55 147.86 51.4 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.996 1.718 . . . . 0.0 108.436 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.35 -36.43 82.19 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 121.148 0.499 . . . . 0.0 110.251 170.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -65.62 96.73 0.28 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.968 0.507 . . . . 0.0 109.922 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.31 -39.38 60.48 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.057 -0.402 . . . . 0.0 110.525 167.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.74 -6.05 44.48 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.206 1.003 . . . . 0.0 113.224 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.1 t 70.32 -58.79 0.54 Allowed 'General case' 0 C--N 1.341 0.201 0 C-N-CA 127.769 2.427 . . . . 0.0 112.798 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.3 m -31.29 113.61 0.11 Allowed 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 127.813 2.445 . . . . 0.0 111.105 165.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 106.57 -11.14 42.53 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 119.187 -0.785 . . . . 0.0 112.763 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 46.7 t . . . . . 0 C--O 1.27 2.167 0 CA-C-O 117.182 -1.389 . . . . 0.0 110.422 178.955 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 . . . . . 0 CA--C 1.539 0.539 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.5 tp -70.29 69.3 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 123.999 0.92 . . . . 0.0 111.144 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 55.1 m -113.64 126.87 55.74 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.379 1.472 . . . . 0.0 108.432 -177.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.22 -38.58 68.63 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.34 0.59 . . . . 0.0 109.949 169.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -66.71 86.0 0.12 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 169.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.53 -35.09 52.66 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.22 1.008 . . . . 0.0 111.365 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.54 -0.35 3.76 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.148 0.979 . . . . 0.0 113.33 176.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.1 t 55.98 35.68 25.98 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 125.365 1.466 . . . . 0.0 111.975 173.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 72.9 m -138.17 134.65 34.8 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 -174.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.79 75.78 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 112.4 -0.28 . . . . 0.0 112.4 -178.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 42.0 t . . . . . 0 C--O 1.27 2.174 0 CA-C-O 117.364 -1.303 . . . . 0.0 110.187 177.067 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 . . . . . 0 CA--C 1.539 0.534 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.6 mt -73.79 72.98 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 O-C-N 121.582 -0.699 . . . . 0.0 109.161 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 35.2 m -105.54 149.95 25.79 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 125.871 1.668 . . . . 0.0 108.432 175.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.41 -45.44 84.59 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 121.452 0.644 . . . . 0.0 109.565 169.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -68.72 92.37 0.48 Allowed 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 168.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.27 -37.65 56.07 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.053 0.541 . . . . 0.0 111.073 174.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.17 4.8 13.75 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.143 0.977 . . . . 0.0 113.036 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 73.29 -52.99 0.7 Allowed 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 126.492 1.917 . . . . 0.0 113.206 174.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.6 m -46.83 111.85 0.44 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.639 1.176 . . . . 0.0 110.669 175.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 115.59 -17.78 15.74 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.227 0.917 . . . . 0.0 112.37 -178.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 43.2 t . . . . . 0 C--O 1.27 2.159 0 CA-C-O 117.182 -1.39 . . . . 0.0 110.74 -176.813 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 . . . . . 0 CA--C 1.533 0.297 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.5 tp -72.88 70.08 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.97 0.908 . . . . 0.0 109.695 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 90.7 m -130.0 -175.96 3.78 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.834 1.254 . . . . 0.0 109.856 -172.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.44 -47.14 69.95 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.313 1.045 . . . . 0.0 112.403 178.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -77.67 76.82 4.19 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-O 121.851 0.834 . . . . 0.0 111.467 -174.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.01 -26.78 11.52 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.753 1.621 . . . . 0.0 111.751 172.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.3 5.91 0.49 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.255 1.022 . . . . 0.0 113.438 172.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 28.2 t 68.15 32.37 4.89 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 125.354 1.462 . . . . 0.0 111.136 174.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 m -79.73 57.44 2.52 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.202 -0.936 . . . . 0.0 108.77 176.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.84 -78.02 0.07 OUTLIER Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.631 1.11 . . . . 0.0 110.786 -170.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 23.7 t . . . . . 0 C--O 1.271 2.208 0 CA-C-O 116.552 -1.69 . . . . 0.0 110.265 -176.279 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 . . . . . 0 CA--C 1.538 0.481 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 25.2 mm -76.23 73.83 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 121.526 -0.734 . . . . 0.0 109.744 -174.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 83.3 m -126.36 121.89 33.83 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 124.869 1.268 . . . . 0.0 108.102 175.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.87 69.65 1.87 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.729 0.812 . . . . 0.0 111.794 -172.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -111.37 164.91 12.43 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.204 1.002 . . . . 0.0 110.265 170.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -49.31 72.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.038 0.535 . . . . 0.0 111.053 175.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.77 68.89 1.34 Allowed 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -177.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.2 t 45.48 34.79 1.72 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.794 1.638 . . . . 0.0 112.933 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 m -81.47 66.42 7.02 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 124.42 1.088 . . . . 0.0 111.686 -155.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.38 52.43 0.33 Allowed Glycine 0 CA--C 1.525 0.685 0 C-N-CA 125.11 1.338 . . . . 0.0 111.181 174.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.27 2.171 0 CA-C-O 116.671 -1.633 . . . . 0.0 108.515 171.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 . . . . . 0 N--CA 1.451 -0.379 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.0 mt -74.41 77.62 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 64.4 m -134.17 178.32 7.06 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 124.943 1.297 . . . . 0.0 109.262 -178.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.96 -20.63 62.57 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.496 0.718 . . . . 0.0 112.259 173.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -67.56 78.14 0.18 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.693 0.797 . . . . 0.0 111.189 176.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.89 -36.79 65.53 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.001 1.321 . . . . 0.0 111.883 -178.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -75.14 36.93 0.12 Allowed 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -173.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 49.74 30.56 3.82 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.174 1.79 . . . . 0.0 113.294 170.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -176.55 149.72 0.81 Allowed 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 124.66 1.184 . . . . 0.0 108.916 -178.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.66 -13.93 13.14 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 124.169 0.89 . . . . 0.0 112.887 168.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 12.0 t . . . . . 0 C--O 1.27 2.165 0 CA-C-O 116.898 -1.525 . . . . 0.0 110.69 179.618 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 . . . . . 0 N--CA 1.452 -0.363 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.6 mm -74.53 71.18 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 34.6 m -148.88 159.98 43.68 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.949 1.7 . . . . 0.0 107.255 -174.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.08 60.39 1.85 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.978 0.511 . . . . 0.0 111.021 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -122.49 90.8 3.37 Favored 'General case' 0 N--CA 1.458 -0.061 0 C-N-CA 124.516 1.126 . . . . 0.0 110.229 -177.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.67 -30.83 34.04 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.116 0.566 . . . . 0.0 111.029 168.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.53 -17.52 22.12 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.465 1.106 . . . . 0.0 113.494 175.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 7.1 t 59.49 32.65 21.83 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.107 0.867 . . . . 0.0 110.59 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 16.1 m -172.49 156.14 3.61 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 126.878 2.071 . . . . 0.0 106.059 -170.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.44 11.65 66.17 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 119.258 -0.746 . . . . 0.0 114.895 161.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 42.1 t . . . . . 0 C--O 1.271 2.201 0 CA-C-O 116.687 -1.625 . . . . 0.0 110.139 171.189 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 44.4 mp0 . . . . . 0 CA--C 1.535 0.376 0 CA-C-O 121.092 0.472 . . . . 0.0 110.822 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 69.3 mt -69.34 85.29 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 167.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 32.3 t -150.04 161.6 42.04 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 123.517 0.727 . . . . 0.0 110.559 -161.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -39.58 -47.66 1.96 Allowed 'General case' 0 C--N 1.341 0.203 0 C-N-CA 126.215 1.806 . . . . 0.0 113.09 -176.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -72.76 78.91 1.12 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 170.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.68 -41.5 55.83 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.634 1.173 . . . . 0.0 110.76 -178.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -84.13 29.22 0.57 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.609 0.764 . . . . 0.0 112.339 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 48.8 t 72.94 -63.08 0.45 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.622 1.969 . . . . 0.0 112.636 175.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 m -53.01 90.21 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.526 2.33 . . . . 0.0 112.649 -166.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 143.57 -32.26 1.85 Allowed Glycine 0 CA--C 1.523 0.537 0 C-N-CA 123.983 0.802 . . . . 0.0 111.263 176.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 6.5 t . . . . . 0 C--O 1.269 2.116 0 CA-C-O 117.187 -1.387 . . . . 0.0 111.015 179.485 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 . . . . . 0 CA--C 1.542 0.652 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.3 tp -72.89 66.58 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-O 122.129 0.966 . . . . 0.0 109.845 174.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 36.9 m -94.48 127.54 40.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.448 1.099 . . . . 0.0 109.524 -174.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.73 -41.44 67.04 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.37 0.605 . . . . 0.0 109.617 168.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -71.18 77.17 0.7 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 167.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -49.81 -38.53 35.04 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.238 1.415 . . . . 0.0 112.342 -172.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -70.23 -4.49 22.0 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.172 1.389 . . . . 0.0 113.675 -178.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 3.6 t 70.2 55.21 0.31 Allowed 'General case' 0 CA--C 1.526 0.039 0 C-N-CA 124.308 1.043 . . . . 0.0 111.506 173.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.9 m -154.77 136.73 14.6 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 176.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.73 30.18 74.19 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 120.009 -0.328 . . . . 0.0 112.593 -178.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 43.7 t . . . . . 0 C--O 1.27 2.147 0 CA-C-O 116.95 -1.5 . . . . 0.0 110.075 178.569 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 CA--C 1.535 0.397 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 54.7 mt -71.68 77.35 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 170.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 29.5 t -113.86 172.56 6.91 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 125.08 1.352 . . . . 0.0 110.834 -165.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -45.44 -45.26 12.81 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.001 0.92 . . . . 0.0 111.235 170.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -74.08 76.11 1.74 Allowed 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 169.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.37 -49.68 53.59 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.905 1.282 . . . . 0.0 111.01 -172.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -78.16 50.4 0.9 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.113 0.565 . . . . 0.0 111.111 177.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 42.3 t 59.71 -67.54 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 127.899 2.48 . . . . 0.0 114.497 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 18.7 m -0.47 82.62 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 130.166 3.387 . . . . 0.0 114.606 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.13 -14.82 62.2 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 118.959 -0.912 . . . . 0.0 114.179 169.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 52.8 t . . . . . 0 C--O 1.27 2.167 0 CA-C-N 118.999 1.399 . . . . 0.0 110.586 -179.02 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 . . . . . 0 N--CA 1.454 -0.246 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 45.8 mt -74.31 71.15 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 173.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 49.8 t -102.02 160.64 14.32 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.205 1.402 . . . . 0.0 110.001 -175.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.96 -40.7 14.87 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.922 0.889 . . . . 0.0 111.966 174.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -80.1 68.88 6.37 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 122.7 1.238 . . . . 0.0 109.501 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -48.84 -48.95 41.34 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 126.946 2.098 . . . . 0.0 114.907 -154.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -78.68 60.15 2.67 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.956 -0.465 . . . . 0.0 110.573 -172.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.4 t 43.81 34.14 0.83 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.133 1.773 . . . . 0.0 111.611 -176.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.6 m -86.18 76.57 9.72 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.944 -1.098 . . . . 0.0 108.67 -160.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.67 -59.49 4.14 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -176.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 48.6 t . . . . . 0 C--O 1.27 2.168 0 CA-C-O 117.53 -1.224 . . . . 0.0 110.106 176.901 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.3 p . . . . . 0 CA--C 1.534 0.341 0 N-CA-C 111.093 0.034 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 17.7 t -149.58 170.27 19.04 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.213 1.405 . . . . 0.0 107.307 173.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 42.6 mp0 -64.61 179.96 0.56 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 162.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 42.0 mt -71.11 78.31 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 10.6 t -141.36 154.16 45.5 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.5 1.52 . . . . 0.0 107.916 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.41 -49.52 44.54 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -167.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -75.03 105.37 6.01 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 -176.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.42 -38.27 52.68 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.771 0.428 . . . . 0.0 111.518 172.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -81.64 1.5 33.72 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.116 0.966 . . . . 0.0 113.046 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 61.17 36.12 18.2 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.831 1.252 . . . . 0.0 112.75 173.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -71.32 63.03 0.36 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.977 1.711 . . . . 0.0 112.302 -172.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 62.02 55.56 27.39 Favored Glycine 0 CA--C 1.528 0.864 0 N-CA-C 109.886 -1.286 . . . . 0.0 109.886 -173.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 8.3 t . . . . . 0 C--O 1.27 2.172 0 CA-C-O 117.364 -1.303 . . . . 0.0 111.228 -174.135 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.453 -0.307 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 12.1 t -176.42 178.34 1.34 Allowed 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 125.302 1.441 . . . . 0.0 107.695 -171.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -65.68 -169.29 0.05 Allowed 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.92 0.391 . . . . 0.0 110.078 160.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.5 mt -72.89 74.29 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.7 m -110.04 150.01 29.17 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 126.078 1.751 . . . . 0.0 109.238 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.78 -49.02 78.0 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 171.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -69.11 92.69 0.55 Allowed 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 166.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.17 -36.13 39.52 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.551 0.74 . . . . 0.0 111.79 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.84 18.02 8.31 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.993 0.917 . . . . 0.0 112.447 178.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.48 4.65 5.14 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.565 1.546 . . . . 0.0 113.723 170.406 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.37 70.85 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.852 2.461 . . . . 0.0 113.348 -173.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.85 32.59 7.89 Favored Glycine 0 CA--C 1.53 0.972 0 C-N-CA 124.591 1.091 . . . . 0.0 111.47 -177.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 35.4 t . . . . . 0 C--O 1.27 2.181 0 CA-C-O 116.422 -1.751 . . . . 0.0 109.371 167.846 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 CA--C 1.539 0.549 0 CA-C-O 121.247 0.546 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 13.8 t -80.75 168.92 18.26 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.081 0.952 . . . . 0.0 111.205 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -55.71 159.54 2.98 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 155.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 25.2 mm -70.9 77.43 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-O 121.301 0.572 . . . . 0.0 110.755 -173.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 47.9 t -145.8 140.15 26.92 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 126.125 1.77 . . . . 0.0 106.921 168.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -81.0 49.73 1.28 Allowed 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -159.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -124.27 108.73 12.55 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 169.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.64 -38.54 64.18 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 117.986 0.357 . . . . 0.0 111.061 172.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.73 -12.98 60.75 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.09 0.956 . . . . 0.0 113.099 177.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.4 t 50.69 39.45 21.8 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.267 1.427 . . . . 0.0 112.892 173.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 91.7 m -140.7 125.7 18.35 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 -175.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 52.49 53.46 31.99 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 123.516 0.579 . . . . 0.0 111.885 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 47.8 t . . . . . 0 C--O 1.268 2.072 0 CA-C-O 116.989 -1.481 . . . . 0.0 111.125 -172.1 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.6 t . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 122.361 1.077 . . . . 0.0 109.511 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 80.4 m -66.62 140.16 57.92 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.696 -0.628 . . . . 0.0 109.828 -177.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -58.25 132.23 52.98 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 175.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 50.4 mt -72.67 77.07 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 173.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 38.4 t -160.84 159.25 29.63 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.461 1.104 . . . . 0.0 108.637 -164.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.79 -19.93 31.82 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -176.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -68.7 84.05 0.29 Allowed 'General case' 0 N--CA 1.454 -0.256 0 O-C-N 121.696 -0.628 . . . . 0.0 110.747 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.88 -26.67 6.12 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.527 1.131 . . . . 0.0 111.43 167.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.15 -18.41 3.75 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.894 1.277 . . . . 0.0 113.599 172.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 48.6 t 60.93 36.91 18.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.077 0.853 . . . . 0.0 110.567 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.8 m -172.44 153.97 3.06 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 127.34 2.256 . . . . 0.0 105.385 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.86 -6.05 83.06 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-O 118.648 -1.085 . . . . 0.0 114.952 164.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 45.5 t . . . . . 0 C--O 1.27 2.156 0 CA-C-N 119.215 1.507 . . . . 0.0 110.314 175.501 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 8.5 t . . . . . 0 N--CA 1.456 -0.166 0 N-CA-C 106.862 -1.533 . . . . 0.0 106.862 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 16.7 t -169.31 172.79 7.01 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 -174.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.6 mp0 -63.26 -175.49 0.11 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 159.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.5 mt -71.27 78.91 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 121.445 -0.784 . . . . 0.0 109.476 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.7 t -141.87 151.84 43.08 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 125.387 1.475 . . . . 0.0 108.445 171.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.22 -33.41 70.95 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.296 0.639 . . . . 0.0 112.131 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 14.4 m-30 -67.75 97.18 0.61 Allowed 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 122.05 -0.406 . . . . 0.0 110.54 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.64 -35.53 61.09 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.958 -0.464 . . . . 0.0 111.49 168.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -74.36 -10.12 59.27 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.11 0.964 . . . . 0.0 112.762 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER 61.28 46.15 8.11 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.861 1.664 . . . . 0.0 112.709 175.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.87 75.52 0.2 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.144 1.378 . . . . 0.0 110.59 -177.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.32 -56.64 4.07 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 37.2 t . . . . . 0 C--O 1.271 2.196 0 CA-C-O 116.91 -1.519 . . . . 0.0 109.072 175.531 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.3 t . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 11.1 t -74.1 170.43 15.5 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.637 0.653 . . . . 0.0 111.102 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.16 175.19 0.15 Allowed 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.097 0.475 . . . . 0.0 109.817 153.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.6 mp -70.63 82.77 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 43.6 t -129.65 153.65 47.9 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 126.091 1.756 . . . . 0.0 107.664 166.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.69 -43.58 26.67 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.713 0.805 . . . . 0.0 111.526 177.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -71.53 90.98 1.03 Allowed 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 173.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.69 -32.22 63.1 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.065 0.546 . . . . 0.0 111.321 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.91 -6.45 57.47 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.848 1.259 . . . . 0.0 112.799 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 76.26 -52.14 0.6 Allowed 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 126.656 1.982 . . . . 0.0 113.743 171.297 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.5 m -39.3 102.28 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.295 1.838 . . . . 0.0 112.752 -175.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 118.78 -31.71 5.43 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 124.326 0.965 . . . . 0.0 112.118 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 45.3 t . . . . . 0 C--O 1.27 2.15 0 CA-C-O 117.211 -1.376 . . . . 0.0 110.426 179.799 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.5 p . . . . . 0 N--CA 1.454 -0.269 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 13.6 t -164.16 175.99 9.66 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 -170.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -58.93 176.88 0.18 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 121.296 0.569 . . . . 0.0 110.154 157.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 49.8 mt -69.82 79.27 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 123.32 0.648 . . . . 0.0 109.269 -178.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.8 t -139.52 152.84 47.25 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 125.797 1.639 . . . . 0.0 108.091 171.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.94 -35.11 68.7 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.314 0.646 . . . . 0.0 112.041 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -69.41 94.68 0.75 Allowed 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 121.995 -0.441 . . . . 0.0 110.57 -178.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.18 -39.07 59.57 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 122.002 -0.437 . . . . 0.0 110.763 167.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.49 -12.89 61.39 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.225 1.01 . . . . 0.0 113.052 176.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.5 t 64.32 45.04 4.01 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.599 1.56 . . . . 0.0 112.493 174.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.9 73.84 0.28 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.122 1.369 . . . . 0.0 110.464 -178.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.06 -57.75 3.97 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -177.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 39.9 t . . . . . 0 C--O 1.27 2.139 0 CA-C-O 117.239 -1.362 . . . . 0.0 109.148 176.753 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.3 t . . . . . 0 CA--C 1.534 0.353 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 11.7 t -163.22 178.66 8.02 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 -67.54 -162.54 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 159.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 28.0 mm -72.42 76.71 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.242 -0.911 . . . . 0.0 109.719 -177.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 55.8 m -128.97 129.8 45.88 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.713 1.605 . . . . 0.0 108.452 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.94 -37.14 73.59 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.269 0.557 . . . . 0.0 110.039 170.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -67.2 85.3 0.15 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 171.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.99 -38.35 50.52 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.475 1.11 . . . . 0.0 111.645 176.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.37 -13.13 36.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.528 1.131 . . . . 0.0 113.199 177.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER 66.21 51.48 1.25 Allowed 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.655 1.182 . . . . 0.0 111.344 172.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 16.9 m -157.62 147.29 20.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 105.632 -1.988 . . . . 0.0 105.632 176.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.6 20.7 70.24 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-O 119.914 -0.381 . . . . 0.0 112.838 -177.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 41.2 t . . . . . 0 C--O 1.269 2.101 0 CA-C-O 117.25 -1.357 . . . . 0.0 110.343 178.987 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 N--CA 1.455 -0.178 0 N-CA-C 106.757 -1.572 . . . . 0.0 106.757 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 7.0 t -169.23 -179.79 3.67 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 107.867 -1.161 . . . . 0.0 107.867 -172.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -73.26 -152.97 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 166.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.3 mt -74.03 75.17 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.103 -0.998 . . . . 0.0 108.995 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 50.8 m -134.32 124.83 26.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.573 1.549 . . . . 0.0 108.117 -178.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.81 -37.02 70.62 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.354 0.597 . . . . 0.0 110.145 171.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -67.32 84.44 0.15 Allowed 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 171.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.16 -31.36 63.31 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.099 0.96 . . . . 0.0 111.554 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.43 -16.91 57.77 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.915 0.886 . . . . 0.0 112.604 174.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 66.5 50.49 1.24 Allowed 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 125.118 1.367 . . . . 0.0 111.23 172.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 17.2 m -157.61 146.91 19.9 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 105.297 -2.112 . . . . 0.0 105.297 175.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.11 23.37 71.32 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-O 119.909 -0.384 . . . . 0.0 112.783 -177.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 44.5 t . . . . . 0 C--O 1.271 2.2 0 CA-C-O 117.274 -1.346 . . . . 0.0 110.185 177.717 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 21.3 p . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 16.8 t -167.83 173.61 8.16 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -173.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 -66.7 -166.0 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 122.812 0.445 . . . . 0.0 109.918 160.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 38.9 mt -71.4 79.63 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 O-C-N 121.408 -0.808 . . . . 0.0 109.47 -176.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 88.8 m -129.55 147.86 51.4 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.996 1.718 . . . . 0.0 108.436 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.35 -36.43 82.19 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 121.148 0.499 . . . . 0.0 110.251 170.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -65.62 96.73 0.28 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.968 0.507 . . . . 0.0 109.922 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.31 -39.38 60.48 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.057 -0.402 . . . . 0.0 110.525 167.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.74 -6.05 44.48 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.206 1.003 . . . . 0.0 113.224 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.1 t 70.32 -58.79 0.54 Allowed 'General case' 0 C--N 1.341 0.201 0 C-N-CA 127.769 2.427 . . . . 0.0 112.798 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.3 m -31.29 113.61 0.11 Allowed 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 127.813 2.445 . . . . 0.0 111.105 165.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 106.57 -11.14 42.53 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 119.187 -0.785 . . . . 0.0 112.763 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 46.7 t . . . . . 0 C--O 1.27 2.167 0 CA-C-O 117.182 -1.389 . . . . 0.0 110.422 178.955 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.6 p . . . . . 0 CA--C 1.535 0.386 0 CA-C-O 121.44 0.638 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 7.2 t -90.24 176.82 6.61 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.645 1.178 . . . . 0.0 110.33 -178.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -65.1 -172.44 0.09 Allowed 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 158.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.5 tp -70.29 69.3 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 123.999 0.92 . . . . 0.0 111.144 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 55.1 m -113.64 126.87 55.74 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.379 1.472 . . . . 0.0 108.432 -177.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.22 -38.58 68.63 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.34 0.59 . . . . 0.0 109.949 169.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -66.71 86.0 0.12 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 169.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.53 -35.09 52.66 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.22 1.008 . . . . 0.0 111.365 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.54 -0.35 3.76 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.148 0.979 . . . . 0.0 113.33 176.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.1 t 55.98 35.68 25.98 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 125.365 1.466 . . . . 0.0 111.975 173.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 72.9 m -138.17 134.65 34.8 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 -174.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.79 75.78 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 112.4 -0.28 . . . . 0.0 112.4 -178.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 42.0 t . . . . . 0 C--O 1.27 2.174 0 CA-C-O 117.364 -1.303 . . . . 0.0 110.187 177.067 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.53 0.2 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 38.6 t -168.34 171.73 8.97 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 -178.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -64.0 -176.39 0.2 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.483 0.713 . . . . 0.0 109.182 161.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.6 mt -73.79 72.98 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 O-C-N 121.582 -0.699 . . . . 0.0 109.161 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 35.2 m -105.54 149.95 25.79 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 125.871 1.668 . . . . 0.0 108.432 175.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.41 -45.44 84.59 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 121.452 0.644 . . . . 0.0 109.565 169.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -68.72 92.37 0.48 Allowed 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 168.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.27 -37.65 56.07 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.053 0.541 . . . . 0.0 111.073 174.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.17 4.8 13.75 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.143 0.977 . . . . 0.0 113.036 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 73.29 -52.99 0.7 Allowed 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 126.492 1.917 . . . . 0.0 113.206 174.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.6 m -46.83 111.85 0.44 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.639 1.176 . . . . 0.0 110.669 175.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 115.59 -17.78 15.74 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.227 0.917 . . . . 0.0 112.37 -178.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 43.2 t . . . . . 0 C--O 1.27 2.159 0 CA-C-O 117.182 -1.39 . . . . 0.0 110.74 -176.813 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.454 -0.26 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 33.9 m -71.61 89.64 1.0 Allowed 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 164.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.64 150.47 47.92 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.791 -0.568 . . . . 0.0 109.521 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.5 tp -72.88 70.08 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.97 0.908 . . . . 0.0 109.695 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 90.7 m -130.0 -175.96 3.78 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.834 1.254 . . . . 0.0 109.856 -172.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.44 -47.14 69.95 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.313 1.045 . . . . 0.0 112.403 178.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -77.67 76.82 4.19 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-O 121.851 0.834 . . . . 0.0 111.467 -174.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.01 -26.78 11.52 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.753 1.621 . . . . 0.0 111.751 172.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.3 5.91 0.49 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.255 1.022 . . . . 0.0 113.438 172.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 28.2 t 68.15 32.37 4.89 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 125.354 1.462 . . . . 0.0 111.136 174.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 m -79.73 57.44 2.52 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.202 -0.936 . . . . 0.0 108.77 176.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.84 -78.02 0.07 OUTLIER Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.631 1.11 . . . . 0.0 110.786 -170.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 23.7 t . . . . . 0 C--O 1.271 2.208 0 CA-C-O 116.552 -1.69 . . . . 0.0 110.265 -176.279 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 CA--C 1.535 0.397 0 CA-C-O 121.438 0.637 . . . . 0.0 110.515 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 12.5 t -67.45 158.46 31.74 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.977 0.511 . . . . 0.0 110.431 176.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.87 171.25 5.53 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 160.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 25.2 mm -76.23 73.83 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 121.526 -0.734 . . . . 0.0 109.744 -174.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 83.3 m -126.36 121.89 33.83 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 124.869 1.268 . . . . 0.0 108.102 175.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.87 69.65 1.87 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.729 0.812 . . . . 0.0 111.794 -172.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -111.37 164.91 12.43 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.204 1.002 . . . . 0.0 110.265 170.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -49.31 72.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.038 0.535 . . . . 0.0 111.053 175.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.77 68.89 1.34 Allowed 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -177.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.2 t 45.48 34.79 1.72 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.794 1.638 . . . . 0.0 112.933 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 m -81.47 66.42 7.02 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 124.42 1.088 . . . . 0.0 111.686 -155.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.38 52.43 0.33 Allowed Glycine 0 CA--C 1.525 0.685 0 C-N-CA 125.11 1.338 . . . . 0.0 111.181 174.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.27 2.171 0 CA-C-O 116.671 -1.633 . . . . 0.0 108.515 171.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.534 0.348 0 CA-C-O 121.402 0.62 . . . . 0.0 109.333 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 76.6 m -76.98 55.93 1.16 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.879 1.272 . . . . 0.0 110.606 -175.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -79.78 154.78 28.26 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.0 mt -74.41 77.62 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 64.4 m -134.17 178.32 7.06 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 124.943 1.297 . . . . 0.0 109.262 -178.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.96 -20.63 62.57 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.496 0.718 . . . . 0.0 112.259 173.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -67.56 78.14 0.18 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.693 0.797 . . . . 0.0 111.189 176.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.89 -36.79 65.53 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.001 1.321 . . . . 0.0 111.883 -178.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -75.14 36.93 0.12 Allowed 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -173.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 49.74 30.56 3.82 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.174 1.79 . . . . 0.0 113.294 170.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -176.55 149.72 0.81 Allowed 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 124.66 1.184 . . . . 0.0 108.916 -178.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.66 -13.93 13.14 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 124.169 0.89 . . . . 0.0 112.887 168.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 12.0 t . . . . . 0 C--O 1.27 2.165 0 CA-C-O 116.898 -1.525 . . . . 0.0 110.69 179.618 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.3 p . . . . . 0 CA--C 1.535 0.39 0 CA-C-O 121.395 0.617 . . . . 0.0 111.632 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 50.4 m -75.88 73.41 2.8 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 173.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -58.52 159.86 6.01 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 172.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.6 mm -74.53 71.18 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 34.6 m -148.88 159.98 43.68 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.949 1.7 . . . . 0.0 107.255 -174.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.08 60.39 1.85 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.978 0.511 . . . . 0.0 111.021 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -122.49 90.8 3.37 Favored 'General case' 0 N--CA 1.458 -0.061 0 C-N-CA 124.516 1.126 . . . . 0.0 110.229 -177.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.67 -30.83 34.04 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.116 0.566 . . . . 0.0 111.029 168.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.53 -17.52 22.12 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.465 1.106 . . . . 0.0 113.494 175.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 7.1 t 59.49 32.65 21.83 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.107 0.867 . . . . 0.0 110.59 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 16.1 m -172.49 156.14 3.61 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 126.878 2.071 . . . . 0.0 106.059 -170.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.44 11.65 66.17 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 119.258 -0.746 . . . . 0.0 114.895 161.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 42.1 t . . . . . 0 C--O 1.271 2.201 0 CA-C-O 116.687 -1.625 . . . . 0.0 110.139 171.189 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.1 t . . . . . 0 CA--C 1.534 0.359 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 70.9 m -98.81 80.55 2.53 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 44.4 mp0 -75.76 161.84 28.7 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.092 0.472 . . . . 0.0 110.822 -177.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 69.3 mt -69.34 85.29 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 167.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 32.3 t -150.04 161.6 42.04 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 123.517 0.727 . . . . 0.0 110.559 -161.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -39.58 -47.66 1.96 Allowed 'General case' 0 C--N 1.341 0.203 0 C-N-CA 126.215 1.806 . . . . 0.0 113.09 -176.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -72.76 78.91 1.12 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 170.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.68 -41.5 55.83 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.634 1.173 . . . . 0.0 110.76 -178.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -84.13 29.22 0.57 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.609 0.764 . . . . 0.0 112.339 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 48.8 t 72.94 -63.08 0.45 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.622 1.969 . . . . 0.0 112.636 175.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 m -53.01 90.21 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.526 2.33 . . . . 0.0 112.649 -166.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 143.57 -32.26 1.85 Allowed Glycine 0 CA--C 1.523 0.537 0 C-N-CA 123.983 0.802 . . . . 0.0 111.263 176.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 6.5 t . . . . . 0 C--O 1.269 2.116 0 CA-C-O 117.187 -1.387 . . . . 0.0 111.015 179.485 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.1 t . . . . . 0 CA--C 1.533 0.31 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 1.5 t -170.69 -158.97 0.16 Allowed 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 -158.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -66.48 -170.46 0.1 Allowed 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 154.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.3 tp -72.89 66.58 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-O 122.129 0.966 . . . . 0.0 109.845 174.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 36.9 m -94.48 127.54 40.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.448 1.099 . . . . 0.0 109.524 -174.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.73 -41.44 67.04 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.37 0.605 . . . . 0.0 109.617 168.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -71.18 77.17 0.7 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 167.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -49.81 -38.53 35.04 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.238 1.415 . . . . 0.0 112.342 -172.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -70.23 -4.49 22.0 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.172 1.389 . . . . 0.0 113.675 -178.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 3.6 t 70.2 55.21 0.31 Allowed 'General case' 0 CA--C 1.526 0.039 0 C-N-CA 124.308 1.043 . . . . 0.0 111.506 173.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.9 m -154.77 136.73 14.6 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 176.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.73 30.18 74.19 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 120.009 -0.328 . . . . 0.0 112.593 -178.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 43.7 t . . . . . 0 C--O 1.27 2.147 0 CA-C-O 116.95 -1.5 . . . . 0.0 110.075 178.569 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 34.6 p . . . . . 0 N--CA 1.453 -0.31 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 92.0 m -71.6 81.46 0.83 Allowed 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.229 1.012 . . . . 0.0 110.372 -172.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -59.57 146.76 39.55 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.171 0.588 . . . . 0.0 109.771 174.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 54.7 mt -71.68 77.35 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 170.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 29.5 t -113.86 172.56 6.91 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 125.08 1.352 . . . . 0.0 110.834 -165.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -45.44 -45.26 12.81 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.001 0.92 . . . . 0.0 111.235 170.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -74.08 76.11 1.74 Allowed 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 169.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.37 -49.68 53.59 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.905 1.282 . . . . 0.0 111.01 -172.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -78.16 50.4 0.9 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.113 0.565 . . . . 0.0 111.111 177.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 42.3 t 59.71 -67.54 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 127.899 2.48 . . . . 0.0 114.497 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 18.7 m -0.47 82.62 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 130.166 3.387 . . . . 0.0 114.606 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.13 -14.82 62.2 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 118.959 -0.912 . . . . 0.0 114.179 169.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 52.8 t . . . . . 0 C--O 1.27 2.167 0 CA-C-N 118.999 1.399 . . . . 0.0 110.586 -179.02 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.6 p . . . . . 0 N--CA 1.453 -0.308 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 57.2 m -72.63 66.75 0.74 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.49 1.116 . . . . 0.0 110.403 -179.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 -61.6 155.87 21.27 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 172.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 45.8 mt -74.31 71.15 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 173.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 49.8 t -102.02 160.64 14.32 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.205 1.402 . . . . 0.0 110.001 -175.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.96 -40.7 14.87 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.922 0.889 . . . . 0.0 111.966 174.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -80.1 68.88 6.37 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 122.7 1.238 . . . . 0.0 109.501 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -48.84 -48.95 41.34 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 126.946 2.098 . . . . 0.0 114.907 -154.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -78.68 60.15 2.67 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.956 -0.465 . . . . 0.0 110.573 -172.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.4 t 43.81 34.14 0.83 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.133 1.773 . . . . 0.0 111.611 -176.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.6 m -86.18 76.57 9.72 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.944 -1.098 . . . . 0.0 108.67 -160.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.67 -59.49 4.14 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -176.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 48.6 t . . . . . 0 C--O 1.27 2.168 0 CA-C-O 117.53 -1.224 . . . . 0.0 110.106 176.901 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 42.6 mp0 . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 42.0 mt -71.11 78.31 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 10.6 t -141.36 154.16 45.5 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.5 1.52 . . . . 0.0 107.916 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.41 -49.52 44.54 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -167.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -75.03 105.37 6.01 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 -176.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.42 -38.27 52.68 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.771 0.428 . . . . 0.0 111.518 172.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -81.64 1.5 33.72 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.116 0.966 . . . . 0.0 113.046 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 61.17 36.12 18.2 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.831 1.252 . . . . 0.0 112.75 173.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -71.32 63.03 0.36 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.977 1.711 . . . . 0.0 112.302 -172.144 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 62.02 55.56 27.39 Favored Glycine 0 CA--C 1.528 0.864 0 N-CA-C 109.886 -1.286 . . . . 0.0 109.886 -173.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 8.3 t . . . . . 0 C--O 1.27 2.172 0 CA-C-O 117.364 -1.303 . . . . 0.0 111.228 -174.135 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 . . . . . 0 CA--C 1.54 0.564 0 CA-C-O 120.92 0.391 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.5 mt -72.89 74.29 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.7 m -110.04 150.01 29.17 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 126.078 1.751 . . . . 0.0 109.238 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.78 -49.02 78.0 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 171.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -69.11 92.69 0.55 Allowed 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 166.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.17 -36.13 39.52 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.551 0.74 . . . . 0.0 111.79 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.84 18.02 8.31 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.993 0.917 . . . . 0.0 112.447 178.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.48 4.65 5.14 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.565 1.546 . . . . 0.0 113.723 170.406 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.37 70.85 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.852 2.461 . . . . 0.0 113.348 -173.31 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.85 32.59 7.89 Favored Glycine 0 CA--C 1.53 0.972 0 C-N-CA 124.591 1.091 . . . . 0.0 111.47 -177.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 35.4 t . . . . . 0 C--O 1.27 2.181 0 CA-C-O 116.422 -1.751 . . . . 0.0 109.371 167.846 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 25.2 mm -70.9 77.43 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-O 121.301 0.572 . . . . 0.0 110.755 -173.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 47.9 t -145.8 140.15 26.92 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 126.125 1.77 . . . . 0.0 106.921 168.24 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -81.0 49.73 1.28 Allowed 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -159.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -124.27 108.73 12.55 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 169.159 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.64 -38.54 64.18 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 117.986 0.357 . . . . 0.0 111.061 172.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.73 -12.98 60.75 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.09 0.956 . . . . 0.0 113.099 177.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.4 t 50.69 39.45 21.8 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.267 1.427 . . . . 0.0 112.892 173.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 91.7 m -140.7 125.7 18.35 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 -175.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 52.49 53.46 31.99 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 123.516 0.579 . . . . 0.0 111.885 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 47.8 t . . . . . 0 C--O 1.268 2.072 0 CA-C-O 116.989 -1.481 . . . . 0.0 111.125 -172.1 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 . . . . . 0 N--CA 1.451 -0.403 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 50.4 mt -72.67 77.07 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 173.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 38.4 t -160.84 159.25 29.63 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.461 1.104 . . . . 0.0 108.637 -164.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.79 -19.93 31.82 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -176.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -68.7 84.05 0.29 Allowed 'General case' 0 N--CA 1.454 -0.256 0 O-C-N 121.696 -0.628 . . . . 0.0 110.747 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.88 -26.67 6.12 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.527 1.131 . . . . 0.0 111.43 167.188 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.15 -18.41 3.75 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.894 1.277 . . . . 0.0 113.599 172.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 48.6 t 60.93 36.91 18.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.077 0.853 . . . . 0.0 110.567 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.8 m -172.44 153.97 3.06 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 127.34 2.256 . . . . 0.0 105.385 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.86 -6.05 83.06 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-O 118.648 -1.085 . . . . 0.0 114.952 164.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 45.5 t . . . . . 0 C--O 1.27 2.156 0 CA-C-N 119.215 1.507 . . . . 0.0 110.314 175.501 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.6 mp0 . . . . . 0 CA--C 1.539 0.553 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.5 mt -71.27 78.91 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 121.445 -0.784 . . . . 0.0 109.476 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.7 t -141.87 151.84 43.08 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 125.387 1.475 . . . . 0.0 108.445 171.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.22 -33.41 70.95 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.296 0.639 . . . . 0.0 112.131 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 14.4 m-30 -67.75 97.18 0.61 Allowed 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 122.05 -0.406 . . . . 0.0 110.54 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.64 -35.53 61.09 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.958 -0.464 . . . . 0.0 111.49 168.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -74.36 -10.12 59.27 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.11 0.964 . . . . 0.0 112.762 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER 61.28 46.15 8.11 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.861 1.664 . . . . 0.0 112.709 175.239 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.87 75.52 0.2 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.144 1.378 . . . . 0.0 110.59 -177.656 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.32 -56.64 4.07 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 37.2 t . . . . . 0 C--O 1.271 2.196 0 CA-C-O 116.91 -1.519 . . . . 0.0 109.072 175.531 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 CA--C 1.538 0.494 0 CA-C-O 121.097 0.475 . . . . 0.0 109.817 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.6 mp -70.63 82.77 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 43.6 t -129.65 153.65 47.9 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 126.091 1.756 . . . . 0.0 107.664 166.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.69 -43.58 26.67 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.713 0.805 . . . . 0.0 111.526 177.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -71.53 90.98 1.03 Allowed 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 173.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.69 -32.22 63.1 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.065 0.546 . . . . 0.0 111.321 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.91 -6.45 57.47 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.848 1.259 . . . . 0.0 112.799 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 76.26 -52.14 0.6 Allowed 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 126.656 1.982 . . . . 0.0 113.743 171.297 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.5 m -39.3 102.28 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.295 1.838 . . . . 0.0 112.752 -175.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 118.78 -31.71 5.43 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 124.326 0.965 . . . . 0.0 112.118 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 45.3 t . . . . . 0 C--O 1.27 2.15 0 CA-C-O 117.211 -1.376 . . . . 0.0 110.426 179.799 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 CA--C 1.537 0.468 0 CA-C-O 121.296 0.569 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 49.8 mt -69.82 79.27 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 123.32 0.648 . . . . 0.0 109.269 -178.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.8 t -139.52 152.84 47.25 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 125.797 1.639 . . . . 0.0 108.091 171.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.94 -35.11 68.7 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.314 0.646 . . . . 0.0 112.041 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -69.41 94.68 0.75 Allowed 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 121.995 -0.441 . . . . 0.0 110.57 -178.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.18 -39.07 59.57 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 122.002 -0.437 . . . . 0.0 110.763 167.336 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.49 -12.89 61.39 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.225 1.01 . . . . 0.0 113.052 176.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.5 t 64.32 45.04 4.01 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.599 1.56 . . . . 0.0 112.493 174.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.9 73.84 0.28 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.122 1.369 . . . . 0.0 110.464 -178.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.06 -57.75 3.97 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -177.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 39.9 t . . . . . 0 C--O 1.27 2.139 0 CA-C-O 117.239 -1.362 . . . . 0.0 109.148 176.753 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 . . . . . 0 CA--C 1.542 0.657 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 28.0 mm -72.42 76.71 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.242 -0.911 . . . . 0.0 109.719 -177.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 55.8 m -128.97 129.8 45.88 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.713 1.605 . . . . 0.0 108.452 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.94 -37.14 73.59 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.269 0.557 . . . . 0.0 110.039 170.205 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -67.2 85.3 0.15 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 171.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.99 -38.35 50.52 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.475 1.11 . . . . 0.0 111.645 176.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.37 -13.13 36.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.528 1.131 . . . . 0.0 113.199 177.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER 66.21 51.48 1.25 Allowed 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.655 1.182 . . . . 0.0 111.344 172.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 16.9 m -157.62 147.29 20.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 105.632 -1.988 . . . . 0.0 105.632 176.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.6 20.7 70.24 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-O 119.914 -0.381 . . . . 0.0 112.838 -177.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 41.2 t . . . . . 0 C--O 1.269 2.101 0 CA-C-O 117.25 -1.357 . . . . 0.0 110.343 178.987 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 . . . . . 0 CA--C 1.543 0.682 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.3 mt -74.03 75.17 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.103 -0.998 . . . . 0.0 108.995 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 50.8 m -134.32 124.83 26.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.573 1.549 . . . . 0.0 108.117 -178.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.81 -37.02 70.62 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.354 0.597 . . . . 0.0 110.145 171.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -67.32 84.44 0.15 Allowed 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 171.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.16 -31.36 63.31 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.099 0.96 . . . . 0.0 111.554 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.43 -16.91 57.77 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.915 0.886 . . . . 0.0 112.604 174.269 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 66.5 50.49 1.24 Allowed 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 125.118 1.367 . . . . 0.0 111.23 172.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 17.2 m -157.61 146.91 19.9 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 105.297 -2.112 . . . . 0.0 105.297 175.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.11 23.37 71.32 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-O 119.909 -0.384 . . . . 0.0 112.783 -177.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 44.5 t . . . . . 0 C--O 1.271 2.2 0 CA-C-O 117.274 -1.346 . . . . 0.0 110.185 177.717 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 38.9 mt -71.4 79.63 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 O-C-N 121.408 -0.808 . . . . 0.0 109.47 -176.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 88.8 m -129.55 147.86 51.4 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.996 1.718 . . . . 0.0 108.436 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.35 -36.43 82.19 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 121.148 0.499 . . . . 0.0 110.251 170.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -65.62 96.73 0.28 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.968 0.507 . . . . 0.0 109.922 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.31 -39.38 60.48 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.057 -0.402 . . . . 0.0 110.525 167.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.74 -6.05 44.48 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.206 1.003 . . . . 0.0 113.224 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.1 t 70.32 -58.79 0.54 Allowed 'General case' 0 C--N 1.341 0.201 0 C-N-CA 127.769 2.427 . . . . 0.0 112.798 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.3 m -31.29 113.61 0.11 Allowed 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 127.813 2.445 . . . . 0.0 111.105 165.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 106.57 -11.14 42.53 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 119.187 -0.785 . . . . 0.0 112.763 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 46.7 t . . . . . 0 C--O 1.27 2.167 0 CA-C-O 117.182 -1.389 . . . . 0.0 110.422 178.955 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 . . . . . 0 CA--C 1.539 0.539 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.5 tp -70.29 69.3 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 123.999 0.92 . . . . 0.0 111.144 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 55.1 m -113.64 126.87 55.74 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.379 1.472 . . . . 0.0 108.432 -177.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.22 -38.58 68.63 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.34 0.59 . . . . 0.0 109.949 169.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -66.71 86.0 0.12 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 169.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.53 -35.09 52.66 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.22 1.008 . . . . 0.0 111.365 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.54 -0.35 3.76 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.148 0.979 . . . . 0.0 113.33 176.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.1 t 55.98 35.68 25.98 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 125.365 1.466 . . . . 0.0 111.975 173.1 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 72.9 m -138.17 134.65 34.8 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 -174.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.79 75.78 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 112.4 -0.28 . . . . 0.0 112.4 -178.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 42.0 t . . . . . 0 C--O 1.27 2.174 0 CA-C-O 117.364 -1.303 . . . . 0.0 110.187 177.067 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 . . . . . 0 CA--C 1.539 0.534 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.6 mt -73.79 72.98 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 O-C-N 121.582 -0.699 . . . . 0.0 109.161 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 35.2 m -105.54 149.95 25.79 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 125.871 1.668 . . . . 0.0 108.432 175.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.41 -45.44 84.59 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 121.452 0.644 . . . . 0.0 109.565 169.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -68.72 92.37 0.48 Allowed 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 168.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.27 -37.65 56.07 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.053 0.541 . . . . 0.0 111.073 174.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.17 4.8 13.75 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.143 0.977 . . . . 0.0 113.036 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 73.29 -52.99 0.7 Allowed 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 126.492 1.917 . . . . 0.0 113.206 174.551 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.6 m -46.83 111.85 0.44 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.639 1.176 . . . . 0.0 110.669 175.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 115.59 -17.78 15.74 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.227 0.917 . . . . 0.0 112.37 -178.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 43.2 t . . . . . 0 C--O 1.27 2.159 0 CA-C-O 117.182 -1.39 . . . . 0.0 110.74 -176.813 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 . . . . . 0 CA--C 1.533 0.297 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.5 tp -72.88 70.08 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.97 0.908 . . . . 0.0 109.695 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 90.7 m -130.0 -175.96 3.78 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.834 1.254 . . . . 0.0 109.856 -172.097 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.44 -47.14 69.95 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.313 1.045 . . . . 0.0 112.403 178.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -77.67 76.82 4.19 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-O 121.851 0.834 . . . . 0.0 111.467 -174.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.01 -26.78 11.52 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.753 1.621 . . . . 0.0 111.751 172.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.3 5.91 0.49 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.255 1.022 . . . . 0.0 113.438 172.269 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 28.2 t 68.15 32.37 4.89 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 125.354 1.462 . . . . 0.0 111.136 174.124 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 m -79.73 57.44 2.52 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.202 -0.936 . . . . 0.0 108.77 176.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.84 -78.02 0.07 OUTLIER Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.631 1.11 . . . . 0.0 110.786 -170.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 23.7 t . . . . . 0 C--O 1.271 2.208 0 CA-C-O 116.552 -1.69 . . . . 0.0 110.265 -176.279 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 . . . . . 0 CA--C 1.538 0.481 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 25.2 mm -76.23 73.83 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 121.526 -0.734 . . . . 0.0 109.744 -174.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 83.3 m -126.36 121.89 33.83 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 124.869 1.268 . . . . 0.0 108.102 175.065 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.87 69.65 1.87 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.729 0.812 . . . . 0.0 111.794 -172.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.49 ' CB ' ' H ' ' A' ' 97' ' ' THR . 70.1 m-85 -111.37 164.91 12.43 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.204 1.002 . . . . 0.0 110.265 170.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -49.31 72.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.038 0.535 . . . . 0.0 111.053 175.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.77 68.89 1.34 Allowed 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -177.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.2 t 45.48 34.79 1.72 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.794 1.638 . . . . 0.0 112.933 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.49 ' H ' ' CB ' ' A' ' 93' ' ' TYR . 1.9 m -81.47 66.42 7.02 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 124.42 1.088 . . . . 0.0 111.686 -155.236 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.38 52.43 0.33 Allowed Glycine 0 CA--C 1.525 0.685 0 C-N-CA 125.11 1.338 . . . . 0.0 111.181 174.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.27 2.171 0 CA-C-O 116.671 -1.633 . . . . 0.0 108.515 171.301 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 . . . . . 0 N--CA 1.451 -0.379 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.0 mt -74.41 77.62 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 64.4 m -134.17 178.32 7.06 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 124.943 1.297 . . . . 0.0 109.262 -178.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.96 -20.63 62.57 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.496 0.718 . . . . 0.0 112.259 173.289 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -67.56 78.14 0.18 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.693 0.797 . . . . 0.0 111.189 176.191 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.89 -36.79 65.53 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.001 1.321 . . . . 0.0 111.883 -178.662 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -75.14 36.93 0.12 Allowed 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -173.507 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 49.74 30.56 3.82 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.174 1.79 . . . . 0.0 113.294 170.273 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -176.55 149.72 0.81 Allowed 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 124.66 1.184 . . . . 0.0 108.916 -178.757 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.66 -13.93 13.14 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 124.169 0.89 . . . . 0.0 112.887 168.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 12.0 t . . . . . 0 C--O 1.27 2.165 0 CA-C-O 116.898 -1.525 . . . . 0.0 110.69 179.618 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 . . . . . 0 N--CA 1.452 -0.363 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.6 mm -74.53 71.18 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 34.6 m -148.88 159.98 43.68 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.949 1.7 . . . . 0.0 107.255 -174.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.08 60.39 1.85 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.978 0.511 . . . . 0.0 111.021 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -122.49 90.8 3.37 Favored 'General case' 0 N--CA 1.458 -0.061 0 C-N-CA 124.516 1.126 . . . . 0.0 110.229 -177.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.67 -30.83 34.04 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.116 0.566 . . . . 0.0 111.029 168.144 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.53 -17.52 22.12 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.465 1.106 . . . . 0.0 113.494 175.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 7.1 t 59.49 32.65 21.83 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.107 0.867 . . . . 0.0 110.59 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 16.1 m -172.49 156.14 3.61 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 126.878 2.071 . . . . 0.0 106.059 -170.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.44 11.65 66.17 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 119.258 -0.746 . . . . 0.0 114.895 161.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 42.1 t . . . . . 0 C--O 1.271 2.201 0 CA-C-O 116.687 -1.625 . . . . 0.0 110.139 171.189 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 44.4 mp0 . . . . . 0 CA--C 1.535 0.376 0 CA-C-O 121.092 0.472 . . . . 0.0 110.822 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 69.3 mt -69.34 85.29 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 167.106 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 32.3 t -150.04 161.6 42.04 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 123.517 0.727 . . . . 0.0 110.559 -161.217 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -39.58 -47.66 1.96 Allowed 'General case' 0 C--N 1.341 0.203 0 C-N-CA 126.215 1.806 . . . . 0.0 113.09 -176.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -72.76 78.91 1.12 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 170.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.68 -41.5 55.83 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.634 1.173 . . . . 0.0 110.76 -178.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -84.13 29.22 0.57 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.609 0.764 . . . . 0.0 112.339 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 48.8 t 72.94 -63.08 0.45 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.622 1.969 . . . . 0.0 112.636 175.47 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 m -53.01 90.21 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.526 2.33 . . . . 0.0 112.649 -166.093 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 143.57 -32.26 1.85 Allowed Glycine 0 CA--C 1.523 0.537 0 C-N-CA 123.983 0.802 . . . . 0.0 111.263 176.031 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 6.5 t . . . . . 0 C--O 1.269 2.116 0 CA-C-O 117.187 -1.387 . . . . 0.0 111.015 179.485 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 . . . . . 0 CA--C 1.542 0.652 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.3 tp -72.89 66.58 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-O 122.129 0.966 . . . . 0.0 109.845 174.064 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 36.9 m -94.48 127.54 40.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.448 1.099 . . . . 0.0 109.524 -174.042 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.73 -41.44 67.04 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.37 0.605 . . . . 0.0 109.617 168.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -71.18 77.17 0.7 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 167.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -49.81 -38.53 35.04 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.238 1.415 . . . . 0.0 112.342 -172.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -70.23 -4.49 22.0 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.172 1.389 . . . . 0.0 113.675 -178.179 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 3.6 t 70.2 55.21 0.31 Allowed 'General case' 0 CA--C 1.526 0.039 0 C-N-CA 124.308 1.043 . . . . 0.0 111.506 173.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.9 m -154.77 136.73 14.6 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 176.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.73 30.18 74.19 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 120.009 -0.328 . . . . 0.0 112.593 -178.611 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 43.7 t . . . . . 0 C--O 1.27 2.147 0 CA-C-O 116.95 -1.5 . . . . 0.0 110.075 178.569 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 CA--C 1.535 0.397 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 54.7 mt -71.68 77.35 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 170.286 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 29.5 t -113.86 172.56 6.91 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 125.08 1.352 . . . . 0.0 110.834 -165.156 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -45.44 -45.26 12.81 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.001 0.92 . . . . 0.0 111.235 170.112 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -74.08 76.11 1.74 Allowed 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 169.467 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.37 -49.68 53.59 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.905 1.282 . . . . 0.0 111.01 -172.054 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -78.16 50.4 0.9 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.113 0.565 . . . . 0.0 111.111 177.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 42.3 t 59.71 -67.54 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 127.899 2.48 . . . . 0.0 114.497 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 18.7 m -0.47 82.62 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 130.166 3.387 . . . . 0.0 114.606 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.13 -14.82 62.2 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 118.959 -0.912 . . . . 0.0 114.179 169.442 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 52.8 t . . . . . 0 C--O 1.27 2.167 0 CA-C-N 118.999 1.399 . . . . 0.0 110.586 -179.02 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 . . . . . 0 N--CA 1.454 -0.246 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 45.8 mt -74.31 71.15 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 173.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 49.8 t -102.02 160.64 14.32 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.205 1.402 . . . . 0.0 110.001 -175.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.96 -40.7 14.87 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.922 0.889 . . . . 0.0 111.966 174.63 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -80.1 68.88 6.37 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 122.7 1.238 . . . . 0.0 109.501 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -48.84 -48.95 41.34 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 126.946 2.098 . . . . 0.0 114.907 -154.607 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -78.68 60.15 2.67 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.956 -0.465 . . . . 0.0 110.573 -172.426 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.4 t 43.81 34.14 0.83 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.133 1.773 . . . . 0.0 111.611 -176.221 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.6 m -86.18 76.57 9.72 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.944 -1.098 . . . . 0.0 108.67 -160.213 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.67 -59.49 4.14 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -176.535 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 48.6 t . . . . . 0 C--O 1.27 2.168 0 CA-C-O 117.53 -1.224 . . . . 0.0 110.106 176.901 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.3 p . . . . . 0 CA--C 1.534 0.341 0 N-CA-C 111.093 0.034 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 17.7 t -149.58 170.27 19.04 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.213 1.405 . . . . 0.0 107.307 173.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 42.6 mp0 -64.61 179.96 0.56 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 162.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 42.0 mt -71.11 78.31 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 10.6 t -141.36 154.16 45.5 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.5 1.52 . . . . 0.0 107.916 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.41 -49.52 44.54 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -167.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -75.03 105.37 6.01 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 -176.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.42 -38.27 52.68 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.771 0.428 . . . . 0.0 111.518 172.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -81.64 1.5 33.72 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.116 0.966 . . . . 0.0 113.046 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 61.17 36.12 18.2 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.831 1.252 . . . . 0.0 112.75 173.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -71.32 63.03 0.36 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.977 1.711 . . . . 0.0 112.302 -172.144 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 62.02 55.56 27.39 Favored Glycine 0 CA--C 1.528 0.864 0 N-CA-C 109.886 -1.286 . . . . 0.0 109.886 -173.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 8.3 t . . . . . 0 C--O 1.27 2.172 0 CA-C-O 117.364 -1.303 . . . . 0.0 111.228 -174.135 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.453 -0.307 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 12.1 t -176.42 178.34 1.34 Allowed 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 125.302 1.441 . . . . 0.0 107.695 -171.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -65.68 -169.29 0.05 Allowed 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.92 0.391 . . . . 0.0 110.078 160.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.5 mt -72.89 74.29 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.7 m -110.04 150.01 29.17 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 126.078 1.751 . . . . 0.0 109.238 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.78 -49.02 78.0 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 171.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -69.11 92.69 0.55 Allowed 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 166.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.17 -36.13 39.52 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.551 0.74 . . . . 0.0 111.79 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.84 18.02 8.31 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.993 0.917 . . . . 0.0 112.447 178.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.48 4.65 5.14 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.565 1.546 . . . . 0.0 113.723 170.406 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.37 70.85 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.852 2.461 . . . . 0.0 113.348 -173.31 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.85 32.59 7.89 Favored Glycine 0 CA--C 1.53 0.972 0 C-N-CA 124.591 1.091 . . . . 0.0 111.47 -177.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 35.4 t . . . . . 0 C--O 1.27 2.181 0 CA-C-O 116.422 -1.751 . . . . 0.0 109.371 167.846 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 CA--C 1.539 0.549 0 CA-C-O 121.247 0.546 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 13.8 t -80.75 168.92 18.26 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.081 0.952 . . . . 0.0 111.205 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -55.71 159.54 2.98 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 155.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 25.2 mm -70.9 77.43 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-O 121.301 0.572 . . . . 0.0 110.755 -173.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 47.9 t -145.8 140.15 26.92 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 126.125 1.77 . . . . 0.0 106.921 168.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -81.0 49.73 1.28 Allowed 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -159.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -124.27 108.73 12.55 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 169.159 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.64 -38.54 64.18 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 117.986 0.357 . . . . 0.0 111.061 172.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.73 -12.98 60.75 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.09 0.956 . . . . 0.0 113.099 177.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.4 t 50.69 39.45 21.8 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.267 1.427 . . . . 0.0 112.892 173.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 91.7 m -140.7 125.7 18.35 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 -175.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 52.49 53.46 31.99 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 123.516 0.579 . . . . 0.0 111.885 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 47.8 t . . . . . 0 C--O 1.268 2.072 0 CA-C-O 116.989 -1.481 . . . . 0.0 111.125 -172.1 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.6 t . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 122.361 1.077 . . . . 0.0 109.511 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 80.4 m -66.62 140.16 57.92 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.696 -0.628 . . . . 0.0 109.828 -177.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -58.25 132.23 52.98 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 175.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 50.4 mt -72.67 77.07 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 173.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 38.4 t -160.84 159.25 29.63 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.461 1.104 . . . . 0.0 108.637 -164.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.79 -19.93 31.82 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -176.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -68.7 84.05 0.29 Allowed 'General case' 0 N--CA 1.454 -0.256 0 O-C-N 121.696 -0.628 . . . . 0.0 110.747 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.88 -26.67 6.12 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.527 1.131 . . . . 0.0 111.43 167.188 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.15 -18.41 3.75 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.894 1.277 . . . . 0.0 113.599 172.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 48.6 t 60.93 36.91 18.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.077 0.853 . . . . 0.0 110.567 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.8 m -172.44 153.97 3.06 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 127.34 2.256 . . . . 0.0 105.385 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.86 -6.05 83.06 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-O 118.648 -1.085 . . . . 0.0 114.952 164.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 45.5 t . . . . . 0 C--O 1.27 2.156 0 CA-C-N 119.215 1.507 . . . . 0.0 110.314 175.501 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 8.5 t . . . . . 0 N--CA 1.456 -0.166 0 N-CA-C 106.862 -1.533 . . . . 0.0 106.862 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 16.7 t -169.31 172.79 7.01 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 -174.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.6 mp0 -63.26 -175.49 0.11 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 159.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.5 mt -71.27 78.91 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 121.445 -0.784 . . . . 0.0 109.476 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.7 t -141.87 151.84 43.08 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 125.387 1.475 . . . . 0.0 108.445 171.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.22 -33.41 70.95 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.296 0.639 . . . . 0.0 112.131 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 14.4 m-30 -67.75 97.18 0.61 Allowed 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 122.05 -0.406 . . . . 0.0 110.54 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.64 -35.53 61.09 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.958 -0.464 . . . . 0.0 111.49 168.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -74.36 -10.12 59.27 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.11 0.964 . . . . 0.0 112.762 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER 61.28 46.15 8.11 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.861 1.664 . . . . 0.0 112.709 175.239 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.87 75.52 0.2 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.144 1.378 . . . . 0.0 110.59 -177.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.32 -56.64 4.07 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 37.2 t . . . . . 0 C--O 1.271 2.196 0 CA-C-O 116.91 -1.519 . . . . 0.0 109.072 175.531 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.3 t . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 11.1 t -74.1 170.43 15.5 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.637 0.653 . . . . 0.0 111.102 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.16 175.19 0.15 Allowed 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.097 0.475 . . . . 0.0 109.817 153.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.6 mp -70.63 82.77 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 43.6 t -129.65 153.65 47.9 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 126.091 1.756 . . . . 0.0 107.664 166.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.69 -43.58 26.67 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.713 0.805 . . . . 0.0 111.526 177.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -71.53 90.98 1.03 Allowed 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 173.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.69 -32.22 63.1 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.065 0.546 . . . . 0.0 111.321 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.91 -6.45 57.47 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.848 1.259 . . . . 0.0 112.799 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 76.26 -52.14 0.6 Allowed 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 126.656 1.982 . . . . 0.0 113.743 171.297 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.5 m -39.3 102.28 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.295 1.838 . . . . 0.0 112.752 -175.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 118.78 -31.71 5.43 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 124.326 0.965 . . . . 0.0 112.118 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 45.3 t . . . . . 0 C--O 1.27 2.15 0 CA-C-O 117.211 -1.376 . . . . 0.0 110.426 179.799 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.5 p . . . . . 0 N--CA 1.454 -0.269 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 13.6 t -164.16 175.99 9.66 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 -170.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -58.93 176.88 0.18 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 121.296 0.569 . . . . 0.0 110.154 157.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 49.8 mt -69.82 79.27 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 123.32 0.648 . . . . 0.0 109.269 -178.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.8 t -139.52 152.84 47.25 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 125.797 1.639 . . . . 0.0 108.091 171.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.94 -35.11 68.7 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.314 0.646 . . . . 0.0 112.041 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -69.41 94.68 0.75 Allowed 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 121.995 -0.441 . . . . 0.0 110.57 -178.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.18 -39.07 59.57 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 122.002 -0.437 . . . . 0.0 110.763 167.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.49 -12.89 61.39 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.225 1.01 . . . . 0.0 113.052 176.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.5 t 64.32 45.04 4.01 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.599 1.56 . . . . 0.0 112.493 174.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.9 73.84 0.28 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.122 1.369 . . . . 0.0 110.464 -178.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.06 -57.75 3.97 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -177.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 39.9 t . . . . . 0 C--O 1.27 2.139 0 CA-C-O 117.239 -1.362 . . . . 0.0 109.148 176.753 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.3 t . . . . . 0 CA--C 1.534 0.353 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 11.7 t -163.22 178.66 8.02 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 -67.54 -162.54 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 159.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 28.0 mm -72.42 76.71 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.242 -0.911 . . . . 0.0 109.719 -177.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 55.8 m -128.97 129.8 45.88 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.713 1.605 . . . . 0.0 108.452 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.94 -37.14 73.59 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.269 0.557 . . . . 0.0 110.039 170.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -67.2 85.3 0.15 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 171.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.99 -38.35 50.52 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.475 1.11 . . . . 0.0 111.645 176.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.37 -13.13 36.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.528 1.131 . . . . 0.0 113.199 177.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER 66.21 51.48 1.25 Allowed 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.655 1.182 . . . . 0.0 111.344 172.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 16.9 m -157.62 147.29 20.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 105.632 -1.988 . . . . 0.0 105.632 176.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.6 20.7 70.24 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-O 119.914 -0.381 . . . . 0.0 112.838 -177.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 41.2 t . . . . . 0 C--O 1.269 2.101 0 CA-C-O 117.25 -1.357 . . . . 0.0 110.343 178.987 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 N--CA 1.455 -0.178 0 N-CA-C 106.757 -1.572 . . . . 0.0 106.757 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 7.0 t -169.23 -179.79 3.67 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 107.867 -1.161 . . . . 0.0 107.867 -172.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -73.26 -152.97 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 166.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.3 mt -74.03 75.17 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.103 -0.998 . . . . 0.0 108.995 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 50.8 m -134.32 124.83 26.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.573 1.549 . . . . 0.0 108.117 -178.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.81 -37.02 70.62 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.354 0.597 . . . . 0.0 110.145 171.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -67.32 84.44 0.15 Allowed 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 171.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.16 -31.36 63.31 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.099 0.96 . . . . 0.0 111.554 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.43 -16.91 57.77 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.915 0.886 . . . . 0.0 112.604 174.269 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 66.5 50.49 1.24 Allowed 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 125.118 1.367 . . . . 0.0 111.23 172.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 17.2 m -157.61 146.91 19.9 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 105.297 -2.112 . . . . 0.0 105.297 175.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.11 23.37 71.32 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-O 119.909 -0.384 . . . . 0.0 112.783 -177.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 44.5 t . . . . . 0 C--O 1.271 2.2 0 CA-C-O 117.274 -1.346 . . . . 0.0 110.185 177.717 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 21.3 p . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 16.8 t -167.83 173.61 8.16 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -173.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 -66.7 -166.0 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 122.812 0.445 . . . . 0.0 109.918 160.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 38.9 mt -71.4 79.63 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 O-C-N 121.408 -0.808 . . . . 0.0 109.47 -176.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 88.8 m -129.55 147.86 51.4 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.996 1.718 . . . . 0.0 108.436 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.35 -36.43 82.19 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 121.148 0.499 . . . . 0.0 110.251 170.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -65.62 96.73 0.28 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.968 0.507 . . . . 0.0 109.922 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.31 -39.38 60.48 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.057 -0.402 . . . . 0.0 110.525 167.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.74 -6.05 44.48 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.206 1.003 . . . . 0.0 113.224 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.1 t 70.32 -58.79 0.54 Allowed 'General case' 0 C--N 1.341 0.201 0 C-N-CA 127.769 2.427 . . . . 0.0 112.798 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.3 m -31.29 113.61 0.11 Allowed 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 127.813 2.445 . . . . 0.0 111.105 165.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 106.57 -11.14 42.53 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 119.187 -0.785 . . . . 0.0 112.763 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 46.7 t . . . . . 0 C--O 1.27 2.167 0 CA-C-O 117.182 -1.389 . . . . 0.0 110.422 178.955 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.6 p . . . . . 0 CA--C 1.535 0.386 0 CA-C-O 121.44 0.638 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 7.2 t -90.24 176.82 6.61 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.645 1.178 . . . . 0.0 110.33 -178.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -65.1 -172.44 0.09 Allowed 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 158.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.5 tp -70.29 69.3 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 123.999 0.92 . . . . 0.0 111.144 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 55.1 m -113.64 126.87 55.74 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.379 1.472 . . . . 0.0 108.432 -177.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.22 -38.58 68.63 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.34 0.59 . . . . 0.0 109.949 169.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -66.71 86.0 0.12 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 169.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.53 -35.09 52.66 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.22 1.008 . . . . 0.0 111.365 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.54 -0.35 3.76 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.148 0.979 . . . . 0.0 113.33 176.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.1 t 55.98 35.68 25.98 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 125.365 1.466 . . . . 0.0 111.975 173.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 72.9 m -138.17 134.65 34.8 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 -174.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.79 75.78 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 112.4 -0.28 . . . . 0.0 112.4 -178.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 42.0 t . . . . . 0 C--O 1.27 2.174 0 CA-C-O 117.364 -1.303 . . . . 0.0 110.187 177.067 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.53 0.2 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 38.6 t -168.34 171.73 8.97 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 -178.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -64.0 -176.39 0.2 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.483 0.713 . . . . 0.0 109.182 161.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.6 mt -73.79 72.98 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 O-C-N 121.582 -0.699 . . . . 0.0 109.161 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 35.2 m -105.54 149.95 25.79 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 125.871 1.668 . . . . 0.0 108.432 175.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.41 -45.44 84.59 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 121.452 0.644 . . . . 0.0 109.565 169.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -68.72 92.37 0.48 Allowed 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 168.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.27 -37.65 56.07 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.053 0.541 . . . . 0.0 111.073 174.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.17 4.8 13.75 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.143 0.977 . . . . 0.0 113.036 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 73.29 -52.99 0.7 Allowed 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 126.492 1.917 . . . . 0.0 113.206 174.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.6 m -46.83 111.85 0.44 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.639 1.176 . . . . 0.0 110.669 175.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 115.59 -17.78 15.74 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.227 0.917 . . . . 0.0 112.37 -178.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 43.2 t . . . . . 0 C--O 1.27 2.159 0 CA-C-O 117.182 -1.39 . . . . 0.0 110.74 -176.813 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.454 -0.26 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 33.9 m -71.61 89.64 1.0 Allowed 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 164.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.64 150.47 47.92 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.791 -0.568 . . . . 0.0 109.521 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.5 tp -72.88 70.08 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.97 0.908 . . . . 0.0 109.695 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 90.7 m -130.0 -175.96 3.78 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.834 1.254 . . . . 0.0 109.856 -172.097 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.44 -47.14 69.95 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.313 1.045 . . . . 0.0 112.403 178.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -77.67 76.82 4.19 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-O 121.851 0.834 . . . . 0.0 111.467 -174.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.01 -26.78 11.52 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.753 1.621 . . . . 0.0 111.751 172.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.3 5.91 0.49 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.255 1.022 . . . . 0.0 113.438 172.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 28.2 t 68.15 32.37 4.89 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 125.354 1.462 . . . . 0.0 111.136 174.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 m -79.73 57.44 2.52 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.202 -0.936 . . . . 0.0 108.77 176.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.84 -78.02 0.07 OUTLIER Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.631 1.11 . . . . 0.0 110.786 -170.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 23.7 t . . . . . 0 C--O 1.271 2.208 0 CA-C-O 116.552 -1.69 . . . . 0.0 110.265 -176.279 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 CA--C 1.535 0.397 0 CA-C-O 121.438 0.637 . . . . 0.0 110.515 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 12.5 t -67.45 158.46 31.74 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.977 0.511 . . . . 0.0 110.431 176.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.87 171.25 5.53 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 160.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 25.2 mm -76.23 73.83 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 121.526 -0.734 . . . . 0.0 109.744 -174.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 83.3 m -126.36 121.89 33.83 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 124.869 1.268 . . . . 0.0 108.102 175.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.87 69.65 1.87 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.729 0.812 . . . . 0.0 111.794 -172.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.49 ' CB ' ' H ' ' A' ' 97' ' ' THR . 70.1 m-85 -111.37 164.91 12.43 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.204 1.002 . . . . 0.0 110.265 170.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -49.31 72.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.038 0.535 . . . . 0.0 111.053 175.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.77 68.89 1.34 Allowed 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -177.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.2 t 45.48 34.79 1.72 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.794 1.638 . . . . 0.0 112.933 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.49 ' H ' ' CB ' ' A' ' 93' ' ' TYR . 1.9 m -81.47 66.42 7.02 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 124.42 1.088 . . . . 0.0 111.686 -155.236 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.38 52.43 0.33 Allowed Glycine 0 CA--C 1.525 0.685 0 C-N-CA 125.11 1.338 . . . . 0.0 111.181 174.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.27 2.171 0 CA-C-O 116.671 -1.633 . . . . 0.0 108.515 171.301 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.534 0.348 0 CA-C-O 121.402 0.62 . . . . 0.0 109.333 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 76.6 m -76.98 55.93 1.16 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.879 1.272 . . . . 0.0 110.606 -175.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -79.78 154.78 28.26 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.0 mt -74.41 77.62 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 64.4 m -134.17 178.32 7.06 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 124.943 1.297 . . . . 0.0 109.262 -178.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.96 -20.63 62.57 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.496 0.718 . . . . 0.0 112.259 173.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -67.56 78.14 0.18 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.693 0.797 . . . . 0.0 111.189 176.191 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.89 -36.79 65.53 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.001 1.321 . . . . 0.0 111.883 -178.662 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -75.14 36.93 0.12 Allowed 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -173.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 49.74 30.56 3.82 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.174 1.79 . . . . 0.0 113.294 170.273 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -176.55 149.72 0.81 Allowed 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 124.66 1.184 . . . . 0.0 108.916 -178.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.66 -13.93 13.14 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 124.169 0.89 . . . . 0.0 112.887 168.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 12.0 t . . . . . 0 C--O 1.27 2.165 0 CA-C-O 116.898 -1.525 . . . . 0.0 110.69 179.618 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.3 p . . . . . 0 CA--C 1.535 0.39 0 CA-C-O 121.395 0.617 . . . . 0.0 111.632 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 50.4 m -75.88 73.41 2.8 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 173.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -58.52 159.86 6.01 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 172.535 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.6 mm -74.53 71.18 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 34.6 m -148.88 159.98 43.68 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.949 1.7 . . . . 0.0 107.255 -174.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.08 60.39 1.85 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.978 0.511 . . . . 0.0 111.021 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -122.49 90.8 3.37 Favored 'General case' 0 N--CA 1.458 -0.061 0 C-N-CA 124.516 1.126 . . . . 0.0 110.229 -177.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.67 -30.83 34.04 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.116 0.566 . . . . 0.0 111.029 168.144 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.53 -17.52 22.12 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.465 1.106 . . . . 0.0 113.494 175.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 7.1 t 59.49 32.65 21.83 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.107 0.867 . . . . 0.0 110.59 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 16.1 m -172.49 156.14 3.61 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 126.878 2.071 . . . . 0.0 106.059 -170.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.44 11.65 66.17 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 119.258 -0.746 . . . . 0.0 114.895 161.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 42.1 t . . . . . 0 C--O 1.271 2.201 0 CA-C-O 116.687 -1.625 . . . . 0.0 110.139 171.189 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.1 t . . . . . 0 CA--C 1.534 0.359 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 70.9 m -98.81 80.55 2.53 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 44.4 mp0 -75.76 161.84 28.7 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.092 0.472 . . . . 0.0 110.822 -177.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 69.3 mt -69.34 85.29 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 167.106 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 32.3 t -150.04 161.6 42.04 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 123.517 0.727 . . . . 0.0 110.559 -161.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -39.58 -47.66 1.96 Allowed 'General case' 0 C--N 1.341 0.203 0 C-N-CA 126.215 1.806 . . . . 0.0 113.09 -176.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -72.76 78.91 1.12 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 170.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.68 -41.5 55.83 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.634 1.173 . . . . 0.0 110.76 -178.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -84.13 29.22 0.57 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.609 0.764 . . . . 0.0 112.339 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 48.8 t 72.94 -63.08 0.45 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.622 1.969 . . . . 0.0 112.636 175.47 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 m -53.01 90.21 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.526 2.33 . . . . 0.0 112.649 -166.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 143.57 -32.26 1.85 Allowed Glycine 0 CA--C 1.523 0.537 0 C-N-CA 123.983 0.802 . . . . 0.0 111.263 176.031 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 6.5 t . . . . . 0 C--O 1.269 2.116 0 CA-C-O 117.187 -1.387 . . . . 0.0 111.015 179.485 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.1 t . . . . . 0 CA--C 1.533 0.31 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 1.5 t -170.69 -158.97 0.16 Allowed 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 -158.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -66.48 -170.46 0.1 Allowed 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 154.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.3 tp -72.89 66.58 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-O 122.129 0.966 . . . . 0.0 109.845 174.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 36.9 m -94.48 127.54 40.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.448 1.099 . . . . 0.0 109.524 -174.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.73 -41.44 67.04 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.37 0.605 . . . . 0.0 109.617 168.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -71.18 77.17 0.7 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 167.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -49.81 -38.53 35.04 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.238 1.415 . . . . 0.0 112.342 -172.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -70.23 -4.49 22.0 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.172 1.389 . . . . 0.0 113.675 -178.179 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 3.6 t 70.2 55.21 0.31 Allowed 'General case' 0 CA--C 1.526 0.039 0 C-N-CA 124.308 1.043 . . . . 0.0 111.506 173.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.9 m -154.77 136.73 14.6 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 176.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.73 30.18 74.19 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 120.009 -0.328 . . . . 0.0 112.593 -178.611 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 43.7 t . . . . . 0 C--O 1.27 2.147 0 CA-C-O 116.95 -1.5 . . . . 0.0 110.075 178.569 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 34.6 p . . . . . 0 N--CA 1.453 -0.31 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 92.0 m -71.6 81.46 0.83 Allowed 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.229 1.012 . . . . 0.0 110.372 -172.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -59.57 146.76 39.55 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.171 0.588 . . . . 0.0 109.771 174.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 54.7 mt -71.68 77.35 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 170.286 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 29.5 t -113.86 172.56 6.91 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 125.08 1.352 . . . . 0.0 110.834 -165.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -45.44 -45.26 12.81 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.001 0.92 . . . . 0.0 111.235 170.112 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -74.08 76.11 1.74 Allowed 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 169.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.37 -49.68 53.59 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.905 1.282 . . . . 0.0 111.01 -172.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -78.16 50.4 0.9 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.113 0.565 . . . . 0.0 111.111 177.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 42.3 t 59.71 -67.54 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 127.899 2.48 . . . . 0.0 114.497 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 18.7 m -0.47 82.62 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 130.166 3.387 . . . . 0.0 114.606 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.13 -14.82 62.2 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 118.959 -0.912 . . . . 0.0 114.179 169.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 52.8 t . . . . . 0 C--O 1.27 2.167 0 CA-C-N 118.999 1.399 . . . . 0.0 110.586 -179.02 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.6 p . . . . . 0 N--CA 1.453 -0.308 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 57.2 m -72.63 66.75 0.74 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.49 1.116 . . . . 0.0 110.403 -179.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 -61.6 155.87 21.27 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 172.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 45.8 mt -74.31 71.15 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 173.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 49.8 t -102.02 160.64 14.32 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.205 1.402 . . . . 0.0 110.001 -175.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.96 -40.7 14.87 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.922 0.889 . . . . 0.0 111.966 174.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -80.1 68.88 6.37 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 122.7 1.238 . . . . 0.0 109.501 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -48.84 -48.95 41.34 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 126.946 2.098 . . . . 0.0 114.907 -154.607 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -78.68 60.15 2.67 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.956 -0.465 . . . . 0.0 110.573 -172.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.4 t 43.81 34.14 0.83 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.133 1.773 . . . . 0.0 111.611 -176.221 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.6 m -86.18 76.57 9.72 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.944 -1.098 . . . . 0.0 108.67 -160.213 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.67 -59.49 4.14 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -176.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 48.6 t . . . . . 0 C--O 1.27 2.168 0 CA-C-O 117.53 -1.224 . . . . 0.0 110.106 176.901 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 42.6 mp0 . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 42.0 mt -71.11 78.31 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 10.6 t -141.36 154.16 45.5 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.5 1.52 . . . . 0.0 107.916 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.41 -49.52 44.54 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -167.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -75.03 105.37 6.01 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 -176.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.42 -38.27 52.68 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.771 0.428 . . . . 0.0 111.518 172.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -81.64 1.5 33.72 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.116 0.966 . . . . 0.0 113.046 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 61.17 36.12 18.2 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.831 1.252 . . . . 0.0 112.75 173.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -71.32 63.03 0.36 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.977 1.711 . . . . 0.0 112.302 -172.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 62.02 55.56 27.39 Favored Glycine 0 CA--C 1.528 0.864 0 N-CA-C 109.886 -1.286 . . . . 0.0 109.886 -173.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 8.3 t . . . . . 0 C--O 1.27 2.172 0 CA-C-O 117.364 -1.303 . . . . 0.0 111.228 -174.135 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 . . . . . 0 CA--C 1.54 0.564 0 CA-C-O 120.92 0.391 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.5 mt -72.89 74.29 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.7 m -110.04 150.01 29.17 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 126.078 1.751 . . . . 0.0 109.238 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.78 -49.02 78.0 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 171.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -69.11 92.69 0.55 Allowed 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 166.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.17 -36.13 39.52 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.551 0.74 . . . . 0.0 111.79 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.84 18.02 8.31 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.993 0.917 . . . . 0.0 112.447 178.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.48 4.65 5.14 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.565 1.546 . . . . 0.0 113.723 170.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.37 70.85 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.852 2.461 . . . . 0.0 113.348 -173.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.85 32.59 7.89 Favored Glycine 0 CA--C 1.53 0.972 0 C-N-CA 124.591 1.091 . . . . 0.0 111.47 -177.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 35.4 t . . . . . 0 C--O 1.27 2.181 0 CA-C-O 116.422 -1.751 . . . . 0.0 109.371 167.846 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 25.2 mm -70.9 77.43 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-O 121.301 0.572 . . . . 0.0 110.755 -173.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 47.9 t -145.8 140.15 26.92 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 126.125 1.77 . . . . 0.0 106.921 168.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -81.0 49.73 1.28 Allowed 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -159.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -124.27 108.73 12.55 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 169.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.64 -38.54 64.18 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 117.986 0.357 . . . . 0.0 111.061 172.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.73 -12.98 60.75 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.09 0.956 . . . . 0.0 113.099 177.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.4 t 50.69 39.45 21.8 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.267 1.427 . . . . 0.0 112.892 173.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 91.7 m -140.7 125.7 18.35 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 -175.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 52.49 53.46 31.99 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 123.516 0.579 . . . . 0.0 111.885 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 47.8 t . . . . . 0 C--O 1.268 2.072 0 CA-C-O 116.989 -1.481 . . . . 0.0 111.125 -172.1 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 . . . . . 0 N--CA 1.451 -0.403 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 50.4 mt -72.67 77.07 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 173.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 38.4 t -160.84 159.25 29.63 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.461 1.104 . . . . 0.0 108.637 -164.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.79 -19.93 31.82 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -176.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -68.7 84.05 0.29 Allowed 'General case' 0 N--CA 1.454 -0.256 0 O-C-N 121.696 -0.628 . . . . 0.0 110.747 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.88 -26.67 6.12 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.527 1.131 . . . . 0.0 111.43 167.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.15 -18.41 3.75 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.894 1.277 . . . . 0.0 113.599 172.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 48.6 t 60.93 36.91 18.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.077 0.853 . . . . 0.0 110.567 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.8 m -172.44 153.97 3.06 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 127.34 2.256 . . . . 0.0 105.385 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.86 -6.05 83.06 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-O 118.648 -1.085 . . . . 0.0 114.952 164.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 45.5 t . . . . . 0 C--O 1.27 2.156 0 CA-C-N 119.215 1.507 . . . . 0.0 110.314 175.501 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.6 mp0 . . . . . 0 CA--C 1.539 0.553 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.5 mt -71.27 78.91 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 121.445 -0.784 . . . . 0.0 109.476 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.7 t -141.87 151.84 43.08 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 125.387 1.475 . . . . 0.0 108.445 171.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.22 -33.41 70.95 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.296 0.639 . . . . 0.0 112.131 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 14.4 m-30 -67.75 97.18 0.61 Allowed 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 122.05 -0.406 . . . . 0.0 110.54 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.64 -35.53 61.09 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.958 -0.464 . . . . 0.0 111.49 168.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -74.36 -10.12 59.27 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.11 0.964 . . . . 0.0 112.762 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER 61.28 46.15 8.11 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.861 1.664 . . . . 0.0 112.709 175.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.87 75.52 0.2 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.144 1.378 . . . . 0.0 110.59 -177.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.32 -56.64 4.07 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 37.2 t . . . . . 0 C--O 1.271 2.196 0 CA-C-O 116.91 -1.519 . . . . 0.0 109.072 175.531 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 CA--C 1.538 0.494 0 CA-C-O 121.097 0.475 . . . . 0.0 109.817 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.6 mp -70.63 82.77 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 43.6 t -129.65 153.65 47.9 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 126.091 1.756 . . . . 0.0 107.664 166.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.69 -43.58 26.67 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.713 0.805 . . . . 0.0 111.526 177.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -71.53 90.98 1.03 Allowed 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 173.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.69 -32.22 63.1 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.065 0.546 . . . . 0.0 111.321 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.91 -6.45 57.47 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.848 1.259 . . . . 0.0 112.799 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 76.26 -52.14 0.6 Allowed 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 126.656 1.982 . . . . 0.0 113.743 171.297 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.5 m -39.3 102.28 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.295 1.838 . . . . 0.0 112.752 -175.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 118.78 -31.71 5.43 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 124.326 0.965 . . . . 0.0 112.118 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 45.3 t . . . . . 0 C--O 1.27 2.15 0 CA-C-O 117.211 -1.376 . . . . 0.0 110.426 179.799 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 CA--C 1.537 0.468 0 CA-C-O 121.296 0.569 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 49.8 mt -69.82 79.27 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 123.32 0.648 . . . . 0.0 109.269 -178.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.8 t -139.52 152.84 47.25 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 125.797 1.639 . . . . 0.0 108.091 171.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.94 -35.11 68.7 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.314 0.646 . . . . 0.0 112.041 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -69.41 94.68 0.75 Allowed 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 121.995 -0.441 . . . . 0.0 110.57 -178.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.18 -39.07 59.57 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 122.002 -0.437 . . . . 0.0 110.763 167.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.49 -12.89 61.39 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.225 1.01 . . . . 0.0 113.052 176.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.5 t 64.32 45.04 4.01 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.599 1.56 . . . . 0.0 112.493 174.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.9 73.84 0.28 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.122 1.369 . . . . 0.0 110.464 -178.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.06 -57.75 3.97 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -177.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 39.9 t . . . . . 0 C--O 1.27 2.139 0 CA-C-O 117.239 -1.362 . . . . 0.0 109.148 176.753 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 . . . . . 0 CA--C 1.542 0.657 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 28.0 mm -72.42 76.71 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.242 -0.911 . . . . 0.0 109.719 -177.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 55.8 m -128.97 129.8 45.88 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.713 1.605 . . . . 0.0 108.452 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.94 -37.14 73.59 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.269 0.557 . . . . 0.0 110.039 170.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -67.2 85.3 0.15 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 171.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.99 -38.35 50.52 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.475 1.11 . . . . 0.0 111.645 176.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.37 -13.13 36.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.528 1.131 . . . . 0.0 113.199 177.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER 66.21 51.48 1.25 Allowed 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.655 1.182 . . . . 0.0 111.344 172.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 16.9 m -157.62 147.29 20.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 105.632 -1.988 . . . . 0.0 105.632 176.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.6 20.7 70.24 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-O 119.914 -0.381 . . . . 0.0 112.838 -177.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 41.2 t . . . . . 0 C--O 1.269 2.101 0 CA-C-O 117.25 -1.357 . . . . 0.0 110.343 178.987 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 . . . . . 0 CA--C 1.543 0.682 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.3 mt -74.03 75.17 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.103 -0.998 . . . . 0.0 108.995 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 50.8 m -134.32 124.83 26.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.573 1.549 . . . . 0.0 108.117 -178.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.81 -37.02 70.62 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.354 0.597 . . . . 0.0 110.145 171.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -67.32 84.44 0.15 Allowed 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 171.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.16 -31.36 63.31 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.099 0.96 . . . . 0.0 111.554 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.43 -16.91 57.77 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.915 0.886 . . . . 0.0 112.604 174.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 66.5 50.49 1.24 Allowed 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 125.118 1.367 . . . . 0.0 111.23 172.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 17.2 m -157.61 146.91 19.9 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 105.297 -2.112 . . . . 0.0 105.297 175.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.11 23.37 71.32 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-O 119.909 -0.384 . . . . 0.0 112.783 -177.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 44.5 t . . . . . 0 C--O 1.271 2.2 0 CA-C-O 117.274 -1.346 . . . . 0.0 110.185 177.717 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 38.9 mt -71.4 79.63 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 O-C-N 121.408 -0.808 . . . . 0.0 109.47 -176.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 88.8 m -129.55 147.86 51.4 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.996 1.718 . . . . 0.0 108.436 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.35 -36.43 82.19 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 121.148 0.499 . . . . 0.0 110.251 170.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -65.62 96.73 0.28 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.968 0.507 . . . . 0.0 109.922 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.31 -39.38 60.48 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.057 -0.402 . . . . 0.0 110.525 167.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.74 -6.05 44.48 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.206 1.003 . . . . 0.0 113.224 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.1 t 70.32 -58.79 0.54 Allowed 'General case' 0 C--N 1.341 0.201 0 C-N-CA 127.769 2.427 . . . . 0.0 112.798 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.3 m -31.29 113.61 0.11 Allowed 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 127.813 2.445 . . . . 0.0 111.105 165.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 106.57 -11.14 42.53 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 119.187 -0.785 . . . . 0.0 112.763 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 46.7 t . . . . . 0 C--O 1.27 2.167 0 CA-C-O 117.182 -1.389 . . . . 0.0 110.422 178.955 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 . . . . . 0 CA--C 1.539 0.539 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.5 tp -70.29 69.3 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 123.999 0.92 . . . . 0.0 111.144 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 55.1 m -113.64 126.87 55.74 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.379 1.472 . . . . 0.0 108.432 -177.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.22 -38.58 68.63 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.34 0.59 . . . . 0.0 109.949 169.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -66.71 86.0 0.12 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 169.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.53 -35.09 52.66 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.22 1.008 . . . . 0.0 111.365 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.54 -0.35 3.76 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.148 0.979 . . . . 0.0 113.33 176.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.1 t 55.98 35.68 25.98 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 125.365 1.466 . . . . 0.0 111.975 173.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 72.9 m -138.17 134.65 34.8 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 -174.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.79 75.78 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 112.4 -0.28 . . . . 0.0 112.4 -178.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 42.0 t . . . . . 0 C--O 1.27 2.174 0 CA-C-O 117.364 -1.303 . . . . 0.0 110.187 177.067 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 . . . . . 0 CA--C 1.539 0.534 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.6 mt -73.79 72.98 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 O-C-N 121.582 -0.699 . . . . 0.0 109.161 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 35.2 m -105.54 149.95 25.79 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 125.871 1.668 . . . . 0.0 108.432 175.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.41 -45.44 84.59 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 121.452 0.644 . . . . 0.0 109.565 169.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -68.72 92.37 0.48 Allowed 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 168.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.27 -37.65 56.07 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.053 0.541 . . . . 0.0 111.073 174.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.17 4.8 13.75 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.143 0.977 . . . . 0.0 113.036 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 73.29 -52.99 0.7 Allowed 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 126.492 1.917 . . . . 0.0 113.206 174.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.6 m -46.83 111.85 0.44 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.639 1.176 . . . . 0.0 110.669 175.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 115.59 -17.78 15.74 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.227 0.917 . . . . 0.0 112.37 -178.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 43.2 t . . . . . 0 C--O 1.27 2.159 0 CA-C-O 117.182 -1.39 . . . . 0.0 110.74 -176.813 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 . . . . . 0 CA--C 1.533 0.297 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.5 tp -72.88 70.08 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.97 0.908 . . . . 0.0 109.695 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 90.7 m -130.0 -175.96 3.78 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.834 1.254 . . . . 0.0 109.856 -172.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.44 -47.14 69.95 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.313 1.045 . . . . 0.0 112.403 178.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -77.67 76.82 4.19 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-O 121.851 0.834 . . . . 0.0 111.467 -174.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.01 -26.78 11.52 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.753 1.621 . . . . 0.0 111.751 172.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.3 5.91 0.49 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.255 1.022 . . . . 0.0 113.438 172.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 28.2 t 68.15 32.37 4.89 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 125.354 1.462 . . . . 0.0 111.136 174.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 m -79.73 57.44 2.52 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.202 -0.936 . . . . 0.0 108.77 176.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.84 -78.02 0.07 OUTLIER Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.631 1.11 . . . . 0.0 110.786 -170.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 23.7 t . . . . . 0 C--O 1.271 2.208 0 CA-C-O 116.552 -1.69 . . . . 0.0 110.265 -176.279 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 . . . . . 0 CA--C 1.538 0.481 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 25.2 mm -76.23 73.83 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 121.526 -0.734 . . . . 0.0 109.744 -174.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 83.3 m -126.36 121.89 33.83 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 124.869 1.268 . . . . 0.0 108.102 175.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.87 69.65 1.87 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.729 0.812 . . . . 0.0 111.794 -172.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.49 ' CB ' ' H ' ' A' ' 97' ' ' THR . 70.1 m-85 -111.37 164.91 12.43 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.204 1.002 . . . . 0.0 110.265 170.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -49.31 72.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.038 0.535 . . . . 0.0 111.053 175.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.77 68.89 1.34 Allowed 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -177.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.2 t 45.48 34.79 1.72 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.794 1.638 . . . . 0.0 112.933 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.49 ' H ' ' CB ' ' A' ' 93' ' ' TYR . 1.9 m -81.47 66.42 7.02 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 124.42 1.088 . . . . 0.0 111.686 -155.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.38 52.43 0.33 Allowed Glycine 0 CA--C 1.525 0.685 0 C-N-CA 125.11 1.338 . . . . 0.0 111.181 174.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.27 2.171 0 CA-C-O 116.671 -1.633 . . . . 0.0 108.515 171.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 . . . . . 0 N--CA 1.451 -0.379 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.0 mt -74.41 77.62 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 64.4 m -134.17 178.32 7.06 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 124.943 1.297 . . . . 0.0 109.262 -178.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.96 -20.63 62.57 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.496 0.718 . . . . 0.0 112.259 173.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -67.56 78.14 0.18 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.693 0.797 . . . . 0.0 111.189 176.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.89 -36.79 65.53 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.001 1.321 . . . . 0.0 111.883 -178.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -75.14 36.93 0.12 Allowed 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -173.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 49.74 30.56 3.82 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.174 1.79 . . . . 0.0 113.294 170.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -176.55 149.72 0.81 Allowed 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 124.66 1.184 . . . . 0.0 108.916 -178.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.66 -13.93 13.14 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 124.169 0.89 . . . . 0.0 112.887 168.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 12.0 t . . . . . 0 C--O 1.27 2.165 0 CA-C-O 116.898 -1.525 . . . . 0.0 110.69 179.618 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 . . . . . 0 N--CA 1.452 -0.363 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.6 mm -74.53 71.18 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 34.6 m -148.88 159.98 43.68 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.949 1.7 . . . . 0.0 107.255 -174.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.08 60.39 1.85 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.978 0.511 . . . . 0.0 111.021 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -122.49 90.8 3.37 Favored 'General case' 0 N--CA 1.458 -0.061 0 C-N-CA 124.516 1.126 . . . . 0.0 110.229 -177.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.67 -30.83 34.04 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.116 0.566 . . . . 0.0 111.029 168.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.53 -17.52 22.12 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.465 1.106 . . . . 0.0 113.494 175.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 7.1 t 59.49 32.65 21.83 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.107 0.867 . . . . 0.0 110.59 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 16.1 m -172.49 156.14 3.61 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 126.878 2.071 . . . . 0.0 106.059 -170.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.44 11.65 66.17 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 119.258 -0.746 . . . . 0.0 114.895 161.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 42.1 t . . . . . 0 C--O 1.271 2.201 0 CA-C-O 116.687 -1.625 . . . . 0.0 110.139 171.189 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 44.4 mp0 . . . . . 0 CA--C 1.535 0.376 0 CA-C-O 121.092 0.472 . . . . 0.0 110.822 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 69.3 mt -69.34 85.29 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 167.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 32.3 t -150.04 161.6 42.04 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 123.517 0.727 . . . . 0.0 110.559 -161.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -39.58 -47.66 1.96 Allowed 'General case' 0 C--N 1.341 0.203 0 C-N-CA 126.215 1.806 . . . . 0.0 113.09 -176.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -72.76 78.91 1.12 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 170.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.68 -41.5 55.83 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.634 1.173 . . . . 0.0 110.76 -178.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -84.13 29.22 0.57 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.609 0.764 . . . . 0.0 112.339 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 48.8 t 72.94 -63.08 0.45 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.622 1.969 . . . . 0.0 112.636 175.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 m -53.01 90.21 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.526 2.33 . . . . 0.0 112.649 -166.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 143.57 -32.26 1.85 Allowed Glycine 0 CA--C 1.523 0.537 0 C-N-CA 123.983 0.802 . . . . 0.0 111.263 176.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 6.5 t . . . . . 0 C--O 1.269 2.116 0 CA-C-O 117.187 -1.387 . . . . 0.0 111.015 179.485 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 . . . . . 0 CA--C 1.542 0.652 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.3 tp -72.89 66.58 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-O 122.129 0.966 . . . . 0.0 109.845 174.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 36.9 m -94.48 127.54 40.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.448 1.099 . . . . 0.0 109.524 -174.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.73 -41.44 67.04 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.37 0.605 . . . . 0.0 109.617 168.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -71.18 77.17 0.7 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 167.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -49.81 -38.53 35.04 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.238 1.415 . . . . 0.0 112.342 -172.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -70.23 -4.49 22.0 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.172 1.389 . . . . 0.0 113.675 -178.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 3.6 t 70.2 55.21 0.31 Allowed 'General case' 0 CA--C 1.526 0.039 0 C-N-CA 124.308 1.043 . . . . 0.0 111.506 173.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.9 m -154.77 136.73 14.6 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 176.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.73 30.18 74.19 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 120.009 -0.328 . . . . 0.0 112.593 -178.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 43.7 t . . . . . 0 C--O 1.27 2.147 0 CA-C-O 116.95 -1.5 . . . . 0.0 110.075 178.569 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 CA--C 1.535 0.397 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 54.7 mt -71.68 77.35 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 170.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 29.5 t -113.86 172.56 6.91 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 125.08 1.352 . . . . 0.0 110.834 -165.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -45.44 -45.26 12.81 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.001 0.92 . . . . 0.0 111.235 170.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -74.08 76.11 1.74 Allowed 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 169.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.37 -49.68 53.59 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.905 1.282 . . . . 0.0 111.01 -172.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -78.16 50.4 0.9 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.113 0.565 . . . . 0.0 111.111 177.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 42.3 t 59.71 -67.54 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 127.899 2.48 . . . . 0.0 114.497 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 18.7 m -0.47 82.62 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 130.166 3.387 . . . . 0.0 114.606 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.13 -14.82 62.2 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 118.959 -0.912 . . . . 0.0 114.179 169.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 52.8 t . . . . . 0 C--O 1.27 2.167 0 CA-C-N 118.999 1.399 . . . . 0.0 110.586 -179.02 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 . . . . . 0 N--CA 1.454 -0.246 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 45.8 mt -74.31 71.15 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 173.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 49.8 t -102.02 160.64 14.32 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.205 1.402 . . . . 0.0 110.001 -175.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.96 -40.7 14.87 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.922 0.889 . . . . 0.0 111.966 174.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -80.1 68.88 6.37 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 122.7 1.238 . . . . 0.0 109.501 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -48.84 -48.95 41.34 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 126.946 2.098 . . . . 0.0 114.907 -154.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -78.68 60.15 2.67 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.956 -0.465 . . . . 0.0 110.573 -172.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.4 t 43.81 34.14 0.83 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.133 1.773 . . . . 0.0 111.611 -176.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.6 m -86.18 76.57 9.72 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.944 -1.098 . . . . 0.0 108.67 -160.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.67 -59.49 4.14 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -176.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 48.6 t . . . . . 0 C--O 1.27 2.168 0 CA-C-O 117.53 -1.224 . . . . 0.0 110.106 176.901 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.3 p . . . . . 0 CA--C 1.534 0.341 0 N-CA-C 111.093 0.034 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 17.7 t -149.58 170.27 19.04 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.213 1.405 . . . . 0.0 107.307 173.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 42.6 mp0 -64.61 179.96 0.56 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 162.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 42.0 mt -71.11 78.31 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 10.6 t -141.36 154.16 45.5 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.5 1.52 . . . . 0.0 107.916 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.41 -49.52 44.54 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -167.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -75.03 105.37 6.01 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 -176.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.42 -38.27 52.68 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.771 0.428 . . . . 0.0 111.518 172.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -81.64 1.5 33.72 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.116 0.966 . . . . 0.0 113.046 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 61.17 36.12 18.2 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.831 1.252 . . . . 0.0 112.75 173.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -71.32 63.03 0.36 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.977 1.711 . . . . 0.0 112.302 -172.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 62.02 55.56 27.39 Favored Glycine 0 CA--C 1.528 0.864 0 N-CA-C 109.886 -1.286 . . . . 0.0 109.886 -173.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 8.3 t . . . . . 0 C--O 1.27 2.172 0 CA-C-O 117.364 -1.303 . . . . 0.0 111.228 -174.135 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.453 -0.307 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 12.1 t -176.42 178.34 1.34 Allowed 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 125.302 1.441 . . . . 0.0 107.695 -171.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -65.68 -169.29 0.05 Allowed 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.92 0.391 . . . . 0.0 110.078 160.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.5 mt -72.89 74.29 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.7 m -110.04 150.01 29.17 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 126.078 1.751 . . . . 0.0 109.238 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.78 -49.02 78.0 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 171.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -69.11 92.69 0.55 Allowed 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 166.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.17 -36.13 39.52 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.551 0.74 . . . . 0.0 111.79 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.84 18.02 8.31 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.993 0.917 . . . . 0.0 112.447 178.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.48 4.65 5.14 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.565 1.546 . . . . 0.0 113.723 170.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.37 70.85 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.852 2.461 . . . . 0.0 113.348 -173.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.85 32.59 7.89 Favored Glycine 0 CA--C 1.53 0.972 0 C-N-CA 124.591 1.091 . . . . 0.0 111.47 -177.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 35.4 t . . . . . 0 C--O 1.27 2.181 0 CA-C-O 116.422 -1.751 . . . . 0.0 109.371 167.846 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 CA--C 1.539 0.549 0 CA-C-O 121.247 0.546 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 13.8 t -80.75 168.92 18.26 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.081 0.952 . . . . 0.0 111.205 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -55.71 159.54 2.98 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 155.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 25.2 mm -70.9 77.43 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-O 121.301 0.572 . . . . 0.0 110.755 -173.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 47.9 t -145.8 140.15 26.92 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 126.125 1.77 . . . . 0.0 106.921 168.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -81.0 49.73 1.28 Allowed 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -159.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -124.27 108.73 12.55 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 169.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.64 -38.54 64.18 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 117.986 0.357 . . . . 0.0 111.061 172.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.73 -12.98 60.75 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.09 0.956 . . . . 0.0 113.099 177.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.4 t 50.69 39.45 21.8 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.267 1.427 . . . . 0.0 112.892 173.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 91.7 m -140.7 125.7 18.35 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 -175.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 52.49 53.46 31.99 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 123.516 0.579 . . . . 0.0 111.885 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 47.8 t . . . . . 0 C--O 1.268 2.072 0 CA-C-O 116.989 -1.481 . . . . 0.0 111.125 -172.1 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.6 t . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 122.361 1.077 . . . . 0.0 109.511 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 80.4 m -66.62 140.16 57.92 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.696 -0.628 . . . . 0.0 109.828 -177.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -58.25 132.23 52.98 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 175.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 50.4 mt -72.67 77.07 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 173.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 38.4 t -160.84 159.25 29.63 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.461 1.104 . . . . 0.0 108.637 -164.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.79 -19.93 31.82 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -176.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -68.7 84.05 0.29 Allowed 'General case' 0 N--CA 1.454 -0.256 0 O-C-N 121.696 -0.628 . . . . 0.0 110.747 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.88 -26.67 6.12 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.527 1.131 . . . . 0.0 111.43 167.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.15 -18.41 3.75 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.894 1.277 . . . . 0.0 113.599 172.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 48.6 t 60.93 36.91 18.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.077 0.853 . . . . 0.0 110.567 175.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.8 m -172.44 153.97 3.06 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 127.34 2.256 . . . . 0.0 105.385 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.86 -6.05 83.06 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-O 118.648 -1.085 . . . . 0.0 114.952 164.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 45.5 t . . . . . 0 C--O 1.27 2.156 0 CA-C-N 119.215 1.507 . . . . 0.0 110.314 175.501 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 8.5 t . . . . . 0 N--CA 1.456 -0.166 0 N-CA-C 106.862 -1.533 . . . . 0.0 106.862 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 16.7 t -169.31 172.79 7.01 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 -174.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.6 mp0 -63.26 -175.49 0.11 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 159.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.5 mt -71.27 78.91 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 121.445 -0.784 . . . . 0.0 109.476 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.7 t -141.87 151.84 43.08 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 125.387 1.475 . . . . 0.0 108.445 171.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.22 -33.41 70.95 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.296 0.639 . . . . 0.0 112.131 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 14.4 m-30 -67.75 97.18 0.61 Allowed 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 122.05 -0.406 . . . . 0.0 110.54 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.64 -35.53 61.09 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.958 -0.464 . . . . 0.0 111.49 168.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -74.36 -10.12 59.27 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.11 0.964 . . . . 0.0 112.762 175.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER 61.28 46.15 8.11 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.861 1.664 . . . . 0.0 112.709 175.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.87 75.52 0.2 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.144 1.378 . . . . 0.0 110.59 -177.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.32 -56.64 4.07 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 37.2 t . . . . . 0 C--O 1.271 2.196 0 CA-C-O 116.91 -1.519 . . . . 0.0 109.072 175.531 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.3 t . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 11.1 t -74.1 170.43 15.5 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.637 0.653 . . . . 0.0 111.102 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.16 175.19 0.15 Allowed 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.097 0.475 . . . . 0.0 109.817 153.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.6 mp -70.63 82.77 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 43.6 t -129.65 153.65 47.9 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 126.091 1.756 . . . . 0.0 107.664 166.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.69 -43.58 26.67 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.713 0.805 . . . . 0.0 111.526 177.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -71.53 90.98 1.03 Allowed 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 173.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.69 -32.22 63.1 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.065 0.546 . . . . 0.0 111.321 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.91 -6.45 57.47 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.848 1.259 . . . . 0.0 112.799 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 76.26 -52.14 0.6 Allowed 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 126.656 1.982 . . . . 0.0 113.743 171.297 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.5 m -39.3 102.28 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.295 1.838 . . . . 0.0 112.752 -175.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 118.78 -31.71 5.43 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 124.326 0.965 . . . . 0.0 112.118 177.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 45.3 t . . . . . 0 C--O 1.27 2.15 0 CA-C-O 117.211 -1.376 . . . . 0.0 110.426 179.799 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.5 p . . . . . 0 N--CA 1.454 -0.269 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 13.6 t -164.16 175.99 9.66 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 -170.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -58.93 176.88 0.18 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 121.296 0.569 . . . . 0.0 110.154 157.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 49.8 mt -69.82 79.27 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 123.32 0.648 . . . . 0.0 109.269 -178.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.8 t -139.52 152.84 47.25 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 125.797 1.639 . . . . 0.0 108.091 171.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.94 -35.11 68.7 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.314 0.646 . . . . 0.0 112.041 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -69.41 94.68 0.75 Allowed 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 121.995 -0.441 . . . . 0.0 110.57 -178.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.18 -39.07 59.57 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 122.002 -0.437 . . . . 0.0 110.763 167.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.49 -12.89 61.39 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.225 1.01 . . . . 0.0 113.052 176.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.5 t 64.32 45.04 4.01 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.599 1.56 . . . . 0.0 112.493 174.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.9 73.84 0.28 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.122 1.369 . . . . 0.0 110.464 -178.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.06 -57.75 3.97 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -177.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 39.9 t . . . . . 0 C--O 1.27 2.139 0 CA-C-O 117.239 -1.362 . . . . 0.0 109.148 176.753 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.3 t . . . . . 0 CA--C 1.534 0.353 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 11.7 t -163.22 178.66 8.02 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 -67.54 -162.54 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 159.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 28.0 mm -72.42 76.71 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 O-C-N 121.242 -0.911 . . . . 0.0 109.719 -177.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 55.8 m -128.97 129.8 45.88 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.713 1.605 . . . . 0.0 108.452 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.94 -37.14 73.59 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.269 0.557 . . . . 0.0 110.039 170.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -67.2 85.3 0.15 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 171.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.99 -38.35 50.52 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.475 1.11 . . . . 0.0 111.645 176.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.37 -13.13 36.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.528 1.131 . . . . 0.0 113.199 177.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER 66.21 51.48 1.25 Allowed 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 124.655 1.182 . . . . 0.0 111.344 172.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 16.9 m -157.62 147.29 20.21 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 105.632 -1.988 . . . . 0.0 105.632 176.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.6 20.7 70.24 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-O 119.914 -0.381 . . . . 0.0 112.838 -177.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 41.2 t . . . . . 0 C--O 1.269 2.101 0 CA-C-O 117.25 -1.357 . . . . 0.0 110.343 178.987 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 N--CA 1.455 -0.178 0 N-CA-C 106.757 -1.572 . . . . 0.0 106.757 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 7.0 t -169.23 -179.79 3.67 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 107.867 -1.161 . . . . 0.0 107.867 -172.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -73.26 -152.97 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 166.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.3 mt -74.03 75.17 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.103 -0.998 . . . . 0.0 108.995 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 50.8 m -134.32 124.83 26.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.573 1.549 . . . . 0.0 108.117 -178.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.81 -37.02 70.62 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.354 0.597 . . . . 0.0 110.145 171.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -67.32 84.44 0.15 Allowed 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 171.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.16 -31.36 63.31 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.099 0.96 . . . . 0.0 111.554 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.43 -16.91 57.77 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.915 0.886 . . . . 0.0 112.604 174.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 66.5 50.49 1.24 Allowed 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 125.118 1.367 . . . . 0.0 111.23 172.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 17.2 m -157.61 146.91 19.9 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 105.297 -2.112 . . . . 0.0 105.297 175.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.11 23.37 71.32 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-O 119.909 -0.384 . . . . 0.0 112.783 -177.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 44.5 t . . . . . 0 C--O 1.271 2.2 0 CA-C-O 117.274 -1.346 . . . . 0.0 110.185 177.717 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 21.3 p . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 16.8 t -167.83 173.61 8.16 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -173.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.4 pm0 -66.7 -166.0 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 122.812 0.445 . . . . 0.0 109.918 160.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 38.9 mt -71.4 79.63 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 O-C-N 121.408 -0.808 . . . . 0.0 109.47 -176.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 88.8 m -129.55 147.86 51.4 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.996 1.718 . . . . 0.0 108.436 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.35 -36.43 82.19 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 121.148 0.499 . . . . 0.0 110.251 170.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -65.62 96.73 0.28 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 122.968 0.507 . . . . 0.0 109.922 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.31 -39.38 60.48 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.057 -0.402 . . . . 0.0 110.525 167.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.74 -6.05 44.48 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.206 1.003 . . . . 0.0 113.224 176.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.1 t 70.32 -58.79 0.54 Allowed 'General case' 0 C--N 1.341 0.201 0 C-N-CA 127.769 2.427 . . . . 0.0 112.798 176.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.3 m -31.29 113.61 0.11 Allowed 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 127.813 2.445 . . . . 0.0 111.105 165.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 106.57 -11.14 42.53 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 119.187 -0.785 . . . . 0.0 112.763 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 46.7 t . . . . . 0 C--O 1.27 2.167 0 CA-C-O 117.182 -1.389 . . . . 0.0 110.422 178.955 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.6 p . . . . . 0 CA--C 1.535 0.386 0 CA-C-O 121.44 0.638 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 7.2 t -90.24 176.82 6.61 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.645 1.178 . . . . 0.0 110.33 -178.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -65.1 -172.44 0.09 Allowed 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 158.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.5 tp -70.29 69.3 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 123.999 0.92 . . . . 0.0 111.144 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 55.1 m -113.64 126.87 55.74 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.379 1.472 . . . . 0.0 108.432 -177.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.22 -38.58 68.63 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.34 0.59 . . . . 0.0 109.949 169.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -66.71 86.0 0.12 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 169.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.53 -35.09 52.66 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.22 1.008 . . . . 0.0 111.365 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.54 -0.35 3.76 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.148 0.979 . . . . 0.0 113.33 176.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.1 t 55.98 35.68 25.98 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 125.365 1.466 . . . . 0.0 111.975 173.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 72.9 m -138.17 134.65 34.8 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 -174.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 63.74 29.79 75.78 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 112.4 -0.28 . . . . 0.0 112.4 -178.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 42.0 t . . . . . 0 C--O 1.27 2.174 0 CA-C-O 117.364 -1.303 . . . . 0.0 110.187 177.067 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.53 0.2 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 38.6 t -168.34 171.73 8.97 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 -178.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -64.0 -176.39 0.2 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.483 0.713 . . . . 0.0 109.182 161.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.6 mt -73.79 72.98 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 O-C-N 121.582 -0.699 . . . . 0.0 109.161 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 35.2 m -105.54 149.95 25.79 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 125.871 1.668 . . . . 0.0 108.432 175.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.41 -45.44 84.59 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 121.452 0.644 . . . . 0.0 109.565 169.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -68.72 92.37 0.48 Allowed 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 168.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.27 -37.65 56.07 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.053 0.541 . . . . 0.0 111.073 174.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.17 4.8 13.75 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.143 0.977 . . . . 0.0 113.036 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 73.29 -52.99 0.7 Allowed 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 126.492 1.917 . . . . 0.0 113.206 174.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 10.6 m -46.83 111.85 0.44 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.639 1.176 . . . . 0.0 110.669 175.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 115.59 -17.78 15.74 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.227 0.917 . . . . 0.0 112.37 -178.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 43.2 t . . . . . 0 C--O 1.27 2.159 0 CA-C-O 117.182 -1.39 . . . . 0.0 110.74 -176.813 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.454 -0.26 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 33.9 m -71.61 89.64 1.0 Allowed 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 164.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.64 150.47 47.92 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.791 -0.568 . . . . 0.0 109.521 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.5 tp -72.88 70.08 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.97 0.908 . . . . 0.0 109.695 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 90.7 m -130.0 -175.96 3.78 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.834 1.254 . . . . 0.0 109.856 -172.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.44 -47.14 69.95 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.313 1.045 . . . . 0.0 112.403 178.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -77.67 76.82 4.19 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-O 121.851 0.834 . . . . 0.0 111.467 -174.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.01 -26.78 11.52 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.753 1.621 . . . . 0.0 111.751 172.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.3 5.91 0.49 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.255 1.022 . . . . 0.0 113.438 172.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 28.2 t 68.15 32.37 4.89 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 125.354 1.462 . . . . 0.0 111.136 174.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 m -79.73 57.44 2.52 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.202 -0.936 . . . . 0.0 108.77 176.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.84 -78.02 0.07 OUTLIER Glycine 0 CA--C 1.529 0.955 0 C-N-CA 124.631 1.11 . . . . 0.0 110.786 -170.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 23.7 t . . . . . 0 C--O 1.271 2.208 0 CA-C-O 116.552 -1.69 . . . . 0.0 110.265 -176.279 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 CA--C 1.535 0.397 0 CA-C-O 121.438 0.637 . . . . 0.0 110.515 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 12.5 t -67.45 158.46 31.74 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.977 0.511 . . . . 0.0 110.431 176.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.87 171.25 5.53 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 160.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 25.2 mm -76.23 73.83 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 121.526 -0.734 . . . . 0.0 109.744 -174.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 83.3 m -126.36 121.89 33.83 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 124.869 1.268 . . . . 0.0 108.102 175.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.87 69.65 1.87 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.729 0.812 . . . . 0.0 111.794 -172.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.49 ' CB ' ' H ' ' A' ' 97' ' ' THR . 70.1 m-85 -111.37 164.91 12.43 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.204 1.002 . . . . 0.0 110.265 170.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -49.31 72.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.038 0.535 . . . . 0.0 111.053 175.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -140.77 68.89 1.34 Allowed 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 -177.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.2 t 45.48 34.79 1.72 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.794 1.638 . . . . 0.0 112.933 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.49 ' H ' ' CB ' ' A' ' 93' ' ' TYR . 1.9 m -81.47 66.42 7.02 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 124.42 1.088 . . . . 0.0 111.686 -155.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.38 52.43 0.33 Allowed Glycine 0 CA--C 1.525 0.685 0 C-N-CA 125.11 1.338 . . . . 0.0 111.181 174.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.27 2.171 0 CA-C-O 116.671 -1.633 . . . . 0.0 108.515 171.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.534 0.348 0 CA-C-O 121.402 0.62 . . . . 0.0 109.333 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 76.6 m -76.98 55.93 1.16 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.879 1.272 . . . . 0.0 110.606 -175.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -79.78 154.78 28.26 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.0 mt -74.41 77.62 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 64.4 m -134.17 178.32 7.06 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 124.943 1.297 . . . . 0.0 109.262 -178.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.96 -20.63 62.57 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.496 0.718 . . . . 0.0 112.259 173.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -67.56 78.14 0.18 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.693 0.797 . . . . 0.0 111.189 176.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.89 -36.79 65.53 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.001 1.321 . . . . 0.0 111.883 -178.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -75.14 36.93 0.12 Allowed 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -173.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 49.74 30.56 3.82 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.174 1.79 . . . . 0.0 113.294 170.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -176.55 149.72 0.81 Allowed 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 124.66 1.184 . . . . 0.0 108.916 -178.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.66 -13.93 13.14 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 124.169 0.89 . . . . 0.0 112.887 168.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 12.0 t . . . . . 0 C--O 1.27 2.165 0 CA-C-O 116.898 -1.525 . . . . 0.0 110.69 179.618 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 1.3 p . . . . . 0 CA--C 1.535 0.39 0 CA-C-O 121.395 0.617 . . . . 0.0 111.632 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 50.4 m -75.88 73.41 2.8 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 173.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -58.52 159.86 6.01 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 172.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.6 mm -74.53 71.18 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 34.6 m -148.88 159.98 43.68 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.949 1.7 . . . . 0.0 107.255 -174.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.08 60.39 1.85 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.978 0.511 . . . . 0.0 111.021 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -122.49 90.8 3.37 Favored 'General case' 0 N--CA 1.458 -0.061 0 C-N-CA 124.516 1.126 . . . . 0.0 110.229 -177.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.67 -30.83 34.04 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.116 0.566 . . . . 0.0 111.029 168.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.53 -17.52 22.12 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.465 1.106 . . . . 0.0 113.494 175.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 7.1 t 59.49 32.65 21.83 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.107 0.867 . . . . 0.0 110.59 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 16.1 m -172.49 156.14 3.61 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 126.878 2.071 . . . . 0.0 106.059 -170.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.44 11.65 66.17 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 119.258 -0.746 . . . . 0.0 114.895 161.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 42.1 t . . . . . 0 C--O 1.271 2.201 0 CA-C-O 116.687 -1.625 . . . . 0.0 110.139 171.189 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.1 t . . . . . 0 CA--C 1.534 0.359 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 70.9 m -98.81 80.55 2.53 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 44.4 mp0 -75.76 161.84 28.7 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.092 0.472 . . . . 0.0 110.822 -177.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 69.3 mt -69.34 85.29 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 167.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 32.3 t -150.04 161.6 42.04 Favored 'General case' 0 C--N 1.333 -0.141 0 C-N-CA 123.517 0.727 . . . . 0.0 110.559 -161.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -39.58 -47.66 1.96 Allowed 'General case' 0 C--N 1.341 0.203 0 C-N-CA 126.215 1.806 . . . . 0.0 113.09 -176.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -72.76 78.91 1.12 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 170.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.68 -41.5 55.83 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.634 1.173 . . . . 0.0 110.76 -178.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -84.13 29.22 0.57 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.609 0.764 . . . . 0.0 112.339 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 48.8 t 72.94 -63.08 0.45 Allowed 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.622 1.969 . . . . 0.0 112.636 175.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 7.1 m -53.01 90.21 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.526 2.33 . . . . 0.0 112.649 -166.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 143.57 -32.26 1.85 Allowed Glycine 0 CA--C 1.523 0.537 0 C-N-CA 123.983 0.802 . . . . 0.0 111.263 176.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 6.5 t . . . . . 0 C--O 1.269 2.116 0 CA-C-O 117.187 -1.387 . . . . 0.0 111.015 179.485 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.1 t . . . . . 0 CA--C 1.533 0.31 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 1.5 t -170.69 -158.97 0.16 Allowed 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 -158.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -66.48 -170.46 0.1 Allowed 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 154.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.3 tp -72.89 66.58 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-O 122.129 0.966 . . . . 0.0 109.845 174.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 36.9 m -94.48 127.54 40.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.448 1.099 . . . . 0.0 109.524 -174.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.73 -41.44 67.04 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.37 0.605 . . . . 0.0 109.617 168.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -71.18 77.17 0.7 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 167.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -49.81 -38.53 35.04 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.238 1.415 . . . . 0.0 112.342 -172.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -70.23 -4.49 22.0 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.172 1.389 . . . . 0.0 113.675 -178.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 3.6 t 70.2 55.21 0.31 Allowed 'General case' 0 CA--C 1.526 0.039 0 C-N-CA 124.308 1.043 . . . . 0.0 111.506 173.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 22.9 m -154.77 136.73 14.6 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 176.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 61.73 30.18 74.19 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-O 120.009 -0.328 . . . . 0.0 112.593 -178.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 43.7 t . . . . . 0 C--O 1.27 2.147 0 CA-C-O 116.95 -1.5 . . . . 0.0 110.075 178.569 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 34.6 p . . . . . 0 N--CA 1.453 -0.31 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 92.0 m -71.6 81.46 0.83 Allowed 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.229 1.012 . . . . 0.0 110.372 -172.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -59.57 146.76 39.55 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.171 0.588 . . . . 0.0 109.771 174.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 54.7 mt -71.68 77.35 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 106.908 -1.516 . . . . 0.0 106.908 170.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 29.5 t -113.86 172.56 6.91 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 125.08 1.352 . . . . 0.0 110.834 -165.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -45.44 -45.26 12.81 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.001 0.92 . . . . 0.0 111.235 170.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -74.08 76.11 1.74 Allowed 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 169.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -50.37 -49.68 53.59 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.905 1.282 . . . . 0.0 111.01 -172.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -78.16 50.4 0.9 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.113 0.565 . . . . 0.0 111.111 177.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 42.3 t 59.71 -67.54 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 127.899 2.48 . . . . 0.0 114.497 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 18.7 m -0.47 82.62 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 130.166 3.387 . . . . 0.0 114.606 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.13 -14.82 62.2 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-O 118.959 -0.912 . . . . 0.0 114.179 169.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 52.8 t . . . . . 0 C--O 1.27 2.167 0 CA-C-N 118.999 1.399 . . . . 0.0 110.586 -179.02 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.6 p . . . . . 0 N--CA 1.453 -0.308 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 57.2 m -72.63 66.75 0.74 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.49 1.116 . . . . 0.0 110.403 -179.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 -61.6 155.87 21.27 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 172.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 45.8 mt -74.31 71.15 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 173.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 49.8 t -102.02 160.64 14.32 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.205 1.402 . . . . 0.0 110.001 -175.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.96 -40.7 14.87 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.922 0.889 . . . . 0.0 111.966 174.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 2.8 m-30 -80.1 68.88 6.37 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 122.7 1.238 . . . . 0.0 109.501 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -48.84 -48.95 41.34 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 126.946 2.098 . . . . 0.0 114.907 -154.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -78.68 60.15 2.67 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.956 -0.465 . . . . 0.0 110.573 -172.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.4 t 43.81 34.14 0.83 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.133 1.773 . . . . 0.0 111.611 -176.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.6 m -86.18 76.57 9.72 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.944 -1.098 . . . . 0.0 108.67 -160.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 78.67 -59.49 4.14 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -176.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 48.6 t . . . . . 0 C--O 1.27 2.168 0 CA-C-O 117.53 -1.224 . . . . 0.0 110.106 176.901 . . . . . . . . 0 0 . 1 stop_ save_